Ibon Alkorta

This is a preview profile on BiomedExperts - the first literature-based scientific social network. It brings the right researchers together and allows them to collaborate online. Collexis and Dell provide the BiomedExperts network of +1.5 Million pre-calculated profiles free of charge to researchers worldwide.

Research Profile (preview)

Phenomena

Concepts & Ideas

Chemicals & Drugs

Sign-in to see full Profile

Sign-in to see all Coauthors

Publications

TOP 3
Elguero José; Alkorta Ibon; Claramunt Rosa M; López Concepción; Sanz Dionísia; María Dolores Santa
Theoretical calculations of a model of NOS indazole inhibitors: interaction of aromatic compounds with Zn-porphyrins.
López Concepción; Claramunt Rosa M; Pinilla Elena; Torres M Rosario; Alkorta Ibon; Elguero José
Molecular complexes between pi-excedent heterocycles (indoles and carbazole) and pi-deficient polynitrobenzenes.
Del Bene Janet E; Alkorta Ibon; Elguero José
A systematic comparison of second-order polarization propagator approximation and equation-of-motion coupled cluster singles and doubles C-C, C-N, N-N, C-H, and N-H spin-spin coupling constants.

Sign-in to see all Publications

Sign in free and see...

Visualized networks:

See your personal network in
sophisticated graphical views

GeoTargeted Searches:

Locate experts around the world
and connect with global collaborators

Research Profiles:

See the visualized research activity
of experts around the globe

Sign-in to see more

Geonetwork of Ibon Alkorta (preview)

Cities where this author has publications
Cities where co-authors of this author have publications

Flash Player Required

Sign-in to see more

All Publications

2009: Elguero José; Alkorta Ibon; Claramunt Rosa M; López Concepción; Sanz Dionísia; María Dolores Santa
Theoretical calculations of a model of NOS indazole inhibitors: interaction of aromatic compounds with Zn-porphyrins.
Bioorganic & medicinal chemistry 2009;17(23):8027-31.
2009: López Concepción; Claramunt Rosa M; Pinilla Elena; Torres M Rosario; Alkorta Ibon; Elguero José
Molecular complexes between pi-excedent heterocycles (indoles and carbazole) and pi-deficient polynitrobenzenes.
Magnetic resonance in chemistry : MRC 2009;47(11):917-24.
2009: Del Bene Janet E; Alkorta Ibon; Elguero José
A systematic comparison of second-order polarization propagator approximation and equation-of-motion coupled cluster singles and doubles C-C, C-N, N-N, C-H, and N-H spin-spin coupling constants.
The journal of physical chemistry. A 2009;113(45):12411-20.
2009: Del Bene Janet E; Alkorta Ibon; Elguero José
Characterizing complexes with F-Li...N, H-Li...N, and CH3Li...N lithium bonds: structures, binding energies, and spin-spin coupling constants.
The journal of physical chemistry. A 2009;113(38):10327-34.
2009: Del Bene Janet E; Alkorta Ibon; Elguero José
Characterizing complexes with F-Li+-F lithium bonds: structures, binding energies, and spin-spin coupling constants.
The journal of physical chemistry. A 2009;113(29):8359-65.
2009: Alkorta Ibon; Blanco Fernando; Elguero José; Dobado José A; Ferrer Santiago Melchor; Vidal Isaac
Carbon...carbon weak interactions.
The journal of physical chemistry. A 2009;113(29):8387-93.
2009: Pi Chengfu; Elguero José; Wan Li; Alkorta Ibon; Zheng Wenjun; Weng Linhong; Chen Zhenxia; Wu Limin
1,2,4-Diazaphospholide complexes of tin(II): from nitride stannylene to stannylenated ammonium ions.
Chemistry (Weinheim an der Bergstrasse, Germany) 2009;15(27):6581-5.
2009: Alkorta Ibon; Elguero José; Limbach Hans-Heinrich; Shenderovich Ilja G; Winkler Tammo
A DFT and AIM analysis of the spin-spin couplings across the hydrogen bond in the 2-fluorobenzamide and related compounds.
Magnetic resonance in chemistry : MRC 2009;47(7):585-92.
2009: Wu Judy I; Pühlhofer Frank G; Schleyer Paul von Ragué; Puchta Ralph; Kiran Boggavarapu; Mauksch Michael; Hommes Nico J R van Eikema; Alkorta Ibon; Elguero José
The effect of perfluorination on the aromaticity of benzene and heterocyclic six-membered rings.
The journal of physical chemistry. A 2009;113(24):6789-94.
2009: Santa María Dolores; Claramunt Rosa M; Alkorta Ibon; Elguero José
The behavior of Gliclazide in solution and in the solid state: a case of organic compound presenting a solid-solution structure.
Magnetic resonance in chemistry : MRC 2009;47(6):472-7.
2009: Alkorta Ibon; Alvarado Mario; Elguero José; García-Granda Santiago; Goya Pilar; Jimeno María Luisa; Menéndez-Taboada Laura
The structure of Rimonabant in the solid state and in solution: an experimental and theoretical study.
European journal of medicinal chemistry 2009;44(5):1864-9.
2009: Blanco Fernando; Alkorta Ibon; Solimannejad Mohammad; Elguero Jose
Theoretical study of the 1:1 complexes between carbon monoxide and hypohalous acids.
The journal of physical chemistry. A 2009;113(13):3237-44.
2009: Estarellas Carolina; Frontera Antonio; Quiñonero David; Alkorta Ibon; Deyà Pere M; Elguero Jose
Energetic vs synergetic stability: a theoretical study.
The journal of physical chemistry. A 2009;113(13):3266-73.
2009: Alkorta Ibon; Blanco Fernando; Elguero José
A theoretical structural analysis of the factors that affect (1)J(NH), (1h)J(NH) and (2h)J(NN) in N-H...N hydrogen-bonded complexes.
Magnetic resonance in chemistry : MRC 2009;47(3):249-56.
2009: Angeles García M; Claramunt Rosa M; Solcan Tomás; Milata Viktor; Alkorta Ibon; Elguero José
13C and 15N NMR spectra of aminobenzimidazoles in solution and in the solid state.
Magnetic resonance in chemistry : MRC 2009;47(2):100-4.
2009: Mata Ignasi; Molins Elies; Alkorta Ibon; Espinosa Enrique
Effect of an external electric field on the dissociation energy and the electron density properties: The case of the hydrogen bonded dimer HF...HF.
The Journal of chemical physics 2009;130(4):044104.
2008: Ballano Gema; Jiménez Ana I; Cativiela Carlos; Claramunt Rosa M; Sanz Dionisia; Alkorta Ibon; Elguero José
Structure of N,N'-bis(amino acids) in the solid state and in solution. A 13C and 15N CPMAS NMR study.
The Journal of organic chemistry 2008;73(21):8575-8.
2008: Del Bene Janet E; Provasi Patricio F; Alkorta Ibon; Elguero José
Resolving an apparent discrepancy between theory and experiment: spin-spin coupling constants for FCCF.
Magnetic resonance in chemistry : MRC 2008;46(11):1003-6.
2008: Alkorta Ibon; Blanco Fernando; Solimannejad Mohammad; Elguero Jose
Competition of hydrogen bonds and halogen bonds in complexes of hypohalous acids with nitrogenated bases.
The journal of physical chemistry. A 2008;112(43):10856-63.
2008: Silva Artur M S; Sousa Regina M S; Jimeno María Luisa; Blanco Fernando; Alkorta Ibon; Elguero José
Experimental measurements and theoretical calculations of the chemical shifts and coupling constants of three azines (benzalazine, acetophenoneazine and cinnamaldazine).
Magnetic resonance in chemistry : MRC 2008;46(9):859-64.
2008: Alkorta Ibon; Elguero José; Solimannejad Mohammad
Dihydrogen bond cooperativity in (HCCBeH)n clusters.
The Journal of chemical physics 2008;129(6):064115.
2008: Del Bene Janet E; Alkorta Ibon; Elguero José
Spin-spin coupling across intermolecular F-Cl...N halogen bonds.
The journal of physical chemistry. A 2008;112(34):7925-9.
2008: Blanco Fernando; Alkorta Ibon; Elguero Jose
The structure of alkali metal derivatives of azoles: N-sigma versus pi structures.
The journal of physical chemistry. A 2008;112(33):7682-8.
2008: Holzer Wolfgang; Claramunt Rosa M A; López Concepción; Alkorta Ibon; Elguero José
A study in desmotropy.
Solid state nuclear magnetic resonance 2008;34(1-2):68-76.
2008: Alkorta Ibon; Blanco Fernando; Elguero Jose
Pi-systems as simultaneous hydride and hydrogen bond acceptors.
The journal of physical chemistry. A 2008;112(29):6753-9.
2008: Del Bene Janet E; Alkorta Ibon; Elguero José
Ab initio EOM-CCSD spin-spin coupling constants for hydrogen-bonded formamide complexes: bridging complexes with NH3, (NH3)2, H2O, (H2O)2, FH, and (FH)2.
The journal of physical chemistry. A 2008;112(28):6338-43.
2008: Alkorta Ibon; Elguero José
Cation dinitrogen complexes [N(2)...X...N(2)]+, X+=H+, Li+, Na+, Be(2+), Mg(2+).
Solid state nuclear magnetic resonance 2008;34(1-2):105-9.
2008: Alkorta Ibon; Elguero José; Denisov Gleb S
A review with comprehensive data on experimental indirect scalar NMR spin-spin coupling constants across hydrogen bonds.
Magnetic resonance in chemistry : MRC 2008;46(7):599-624.
2008: Del Bene Janet E; Alkorta Ibon; Elguero José
Spin-spin coupling across intramolecular N-H(+)-N hydrogen bonds in models for proton sponges: an ab initio investigation.
Magnetic resonance in chemistry : MRC 2008;46(5):457-63.
2008: Alkorta Ibon; Provasi Patricio F; Aucar Gustavo A; Elguero José
A computational study of 2J(HH)(gem) indirect spin-spin coupling constants in simple hydrides of the second and third periods.
Magnetic resonance in chemistry : MRC 2008;46(4):356-61.
2008: Alkorta Ibon; Elguero José; Grabowski Slawomir J
How to determine whether intramolecular H...H interactions can be classified as dihydrogen bonds.
The journal of physical chemistry. A 2008;112(12):2721-7.
2008: Sánchez Marina; Ferraro Marta B; Alkorta Ibon; Elguero José; Sauer Stephan P A
Atomic partition of the optical rotatory power of methylhydroperoxide.
The Journal of chemical physics 2008;128(6):064318.
2008: Alkorta Ibon; Blanco Fernando; Elguero José
Molecular complexes of pentazolo[1,2-a]pentazole, N8.
The journal of physical chemistry. A 2008;112(8):1817-22.
2008: Roussel Christian; Vanthuyne Nicolas; Bouchekara Mohamed; Djafri Ayada; Elguero José; Alkorta Ibon
Atropisomerism in the 2-arylimino-N-(2-hydroxyphenyl)thiazoline series: influence of hydrogen bonding on the racemization process.
The Journal of organic chemistry 2008;73(2):403-11.
2008: García-Frutos Eva M; Gómez-Lor Berta; Monge Angeles; Gutiérrez-Puebla Enrique; Alkorta Ibon; Elguero José
Synthesis and preferred all-syn conformation of C3-symmetrical N-(hetero)arylmethyl triindoles.
Chemistry (Weinheim an der Bergstrasse, Germany) 2008;14(28):8555-61.
2008: Rodríguez-Morgade M Salomé; Claessens Christian G; Medina Anaïs; González-Rodríguez David; Gutiérrez-Puebla Enrique; Monge Angeles; Alkorta Ibon; Elguero José; Torres Tomás
Synthesis, characterization, molecular structure and theoretical studies of axially fluoro-substituted subazaporphyrins.
Chemistry (Weinheim an der Bergstrasse, Germany) 2008;14(4):1342-50.
2007: Alkorta Ibon; Elguero José; Bene Janet E Del
HC[triple bond]P and H3C-C[triple bond]P as proton acceptors in protonated complexes containing two phosphorus bases: structures, binding energies, and spin-spin coupling constants.
The journal of physical chemistry. A 2007;111(39):9924-30.
2007: Santa María M Dolores; Claramunt Rosa M; Alkorta Ibon; Elguero José
A theoretical and experimental study of the fluxional behaviour of molybdenum dihydrobis- and hydrotris-pyrazolylborates.
Dalton transactions (Cambridge, England : 2003) 2007;(36):3995-9.
2007: Blanco Fernando; Alkorta Ibon; Elguero José
Statistical analysis of (13)C and (15)N NMR chemical shifts from GIAO/B3LYP/6-311 + + G** calculated absolute shieldings.
Magnetic resonance in chemistry : MRC 2007;45(9):797-800.
2007: Mó Otilia; Yáñez Manuel; Martín Pendás Angel; Del Bene Janet E; Alkorta Ibon; Elguero José
Unusual substituent effects on the bonding of iminoboranes.
Physical chemistry chemical physics : PCCP 2007;9(30):3970-7.
2007: Alkorta Ibon; Solimannejad Mohammad; Provasi Patricio; Elguero Jose
Theoretical study of complexes and fluoride cation transfer between N2F+ and electron donors.
The journal of physical chemistry. A 2007;111(30):7154-61.
2007: Mata Ignasi; Molins Elies; Alkorta Ibon; Espinosa Enrique
Topological properties of the electrostatic potential in weak and moderate N...H hydrogen bonds.
The journal of physical chemistry. A 2007;111(28):6425-33.
2007: Sanz Dionisia; Claramunt Rosa M; Saini Anil; Kumar Vinod; Aggarwal Ranjana; Singh Shiv P; Alkorta Ibon; Elguero José
Pyrazolo[1,5-a]pyrimidines. A combined multinuclear magnetic resonance (1H, 13C, 15N, 19F) and DFT approach to their structural assignment.
Magnetic resonance in chemistry : MRC 2007;45(6):513-7.
2007: Del Bene Janet E; Elguero José; Alkorta Ibon
Probing P-H+-P hydrogen bonds: structures, binding energies, and spin-spin coupling constants.
The journal of physical chemistry. A 2007;111(17):3416-22.
2007: Alkorta Ibon; Quiñonero David; Garau Carolina; Frontera Antonio; Elguero José; Deyà Pere M
Dual cation and anion acceptor molecules. The case of the (eta6-C6H6)(eta6C6F6)Cr0 complex.
The journal of physical chemistry. A 2007;111(16):3137-42.
2007: Solimannejad Mohammad; Alkorta Ibon; Elguero Jose
Weakly bound complexes of N2O: an ab initio theoretical analysis toward the design of N2O receptors.
The journal of physical chemistry. A 2007;111(11):2077-83.
2007: Alkorta Ibon; Elguero Jose; Zborowski Krzysztof
Chiral recognition in diaziridine clusters and the problem of racemization waves.
The journal of physical chemistry. A 2007;111(6):1096-103.
2007: Del Bene Janet E; Elguero José; Alkorta Ibon; Yañez Manuel; Mó Otilia
Attacking boron nucleophiles: NMR properties of five-membered diazaborole rings.
The journal of physical chemistry. A 2007;111(3):419-21.
2006: Rozas Isabel; Alkorta Ibon; Elguero José
Stereoisomer discrimination in complexes of halogen-substituted difuranes and Li or Na cations.
The journal of physical chemistry. A 2006;110(49):13310-6.
2006: Navarro Pilar; Reviriego Felipe; Alkorta Ibon; Elguero José; López Concepción; Claramunt Rosa M; García-España Enrique
The structure of ammonium pyrazolates in the solid state.
Magnetic resonance in chemistry : MRC 2006;44(12):1067-72.
2006: Solimannejad Mohammad; Alkorta Ibon
Competition between nonclassical hydrogen-bonded acceptor sites in complexes of neutral AH2 Radicals (A = B, Al, and Ga): A theoretical investigation.
The journal of physical chemistry. A 2006;110(37):10817-21.
2006: Alkorta Ibon; Zborowski Krzysztof; Elguero Jose; Solimannejad Mohammad
Theoretical study of dihydrogen bonds between (XH)2, X = Li, Na, BeH, and MgH, and weak hydrogen bond donors (HCN, HNC, and HCCH).
The journal of physical chemistry. A 2006;110(34):10279-86.
2006: Del Bene Janet E; Elguero José; Alkorta Ibon; Yañez Manuel; Mó Otilia
An ab initio study of 15N-11B spin-spin coupling constants for borazine and selected derivatives.
The journal of physical chemistry. A 2006;110(32):9959-66.
2006: Alkorta Ibon; Elguero José
Theoretical models of directional proton molecular transport.
Organic & biomolecular chemistry 2006;4(16):3096-101.
2006: Jimeno María-Luisa; Alkorta Ibon; Elguero José; Del Bene Janet E
Computed coupling constants in X(CH3)nH(4-n) moieties where X = 13C and 15N+, and n = 0-4: comparisons with experimental data.
Magnetic resonance in chemistry : MRC 2006;44(7):698-707.
2006: Zborowski Krzysztof; Alkorta Ibon; Elguero Jose
Effect of dimerization and racemization processes on the electron density and the optical rotatory power of hydrogen peroxide derivatives.
The journal of physical chemistry. A 2006;110(22):7247-52.
2006: Claramunt Rosa M; Santa María M Dolores; Sanz Dionisia; Alkorta Ibon; Elguero José
A 1H, 13C and 15N NMR study in solution and in the solid state of six N-substituted pyrazoles and indazoles.
Magnetic resonance in chemistry : MRC 2006;44(5):566-70.
2006: Alkorta Ibon; Picazo Oscar; Elguero José
Chiral recognition in self-complexes of tetrahydroimidazo[4,5-d]imidazole derivatives: from dimers to heptamers.
The journal of physical chemistry. A 2006;110(6):2259-68.
2006: Jagerovic Nadine; Hernandez-Folgado Laura; Alkorta Ibon; Goya Pilar; Martín María Isabel; Dannert María Teresa; Alsasua Angela; Frigola Jordi; Cuberes María Rosa; Dordal Alberto; Holenz Jörg
Structural-activity relationship study on C-4 carbon atom of the CB1 antagonist SR141716: synthesis and pharmacological evaluation of 1,2,4-triazole-3-carboxamides.
European journal of medicinal chemistry 2006;41(1):114-20.
2005: Sanz Dionisia; Claramunt Rosa M; Singh Shiv P; Kumar Vinod; Aggarwal Ranjana; Elguero José; Alkorta Ibon
Structure of the products of condensation of hydroxylamine with trifluoromethyl-beta-diketones: assignments of the diastereotopic protons of the 4-methylene group in 5-hydroxy-5-trifluoromethyl-delta2-isoxazolines.
Magnetic resonance in chemistry : MRC 2005;43(12):1040-3.
2005: Claramunt Rosa M; Sanz Dionisia; Alkorta Ibon; Elguero José
A theoretical study of multinuclear coupling constants in pyrazoles.
Magnetic resonance in chemistry : MRC 2005;43(12):985-91.
2005: Abarca Belén; Alkorta Ibon; Ballesteros Rafael; Blanco Fernando; Chadlaoui Mimoun; Elguero José; Mojarrad Fatemeh
3-(2-Pyridyl)-[1,2,3]triazolo[1,5-a]pyridines. An experimental and theoretical (DFT) study of the ring-chain isomerization.
Organic & biomolecular chemistry 2005;3(21):3905-10.
2005: Alkorta Ibon; Picazo Oscar; Elguero José
Chiral discrimination in lithium complexes of bis(5H-pyrroles) and bis(oxazolines).
The journal of physical chemistry. A 2005;109(42):9573-7.
2005: Sanchez Marina; Provasi Patricio F; Aucar Gustavo A; Alkorta Ibon; Elguero Jose
Theoretical study of HCN and HNC neutral and charged clusters.
The journal of physical chemistry. B 2005;109(38):18189-94.
2005: Provasi Patricio F; Aucar Gustavo A; Sanchez Marina; Alkorta Ibon; Elguero José; Sauer Stephan P A
Interaction energies and NMR indirect nuclear spin-spin coupling constants in linear HCN and HNC complexes.
The journal of physical chemistry. A 2005;109(29):6555-64.
2005: Espinosa Enrique; Alkorta Ibon; Mata Ignasi; Molins Elies
Topological analysis of the electron density distribution in perturbed systems. I. Effect of charge on the bond properties of hydrogen fluoride.
The journal of physical chemistry. A 2005;109(29):6532-9.
2005: Mó Otilia; Yáñez Manuel; Del Bene Janet E; Alkorta Ibon; Elguero José
Cooperativity and proton transfer in hydrogen-bonded triads.
Chemphyschem : a European journal of chemical physics and physical chemistry 2005;6(7):1411-8.
2005: Fruchier Alain; Vicente Virginie; Alkorta Ibon; Elguero José
Theoretical study of 31P, 31P coupling constants in cyclotriphosphazenes.
Magnetic resonance in chemistry : MRC 2005;43(6):471-4.
2005: Mó Otilia; Yáñez Manuel; Eckert-Maksic Mirjana; Maksic Zvonimir B; Alkorta Ibón; Elguero José
Periodic trends in bond dissociation energies. A theoretical study.
The journal of physical chemistry. A 2005;109(19):4359-65.
2005: Alkorta Ibon; Picazo Oscar; Elguero Jose
Chiral recognition in cyclic alpha-hydroxy carbonyl compounds: a theoretical study.
The journal of physical chemistry. A 2005;109(14):3262-6.
2005: Del Bene Janet E; Elguero José; Alkorta Ibon; Mó Otilia; Yañez Manuel
Ab initio study of the influence of trimer formation on one- and two-bond spin-spin coupling constants across an X-H-Y hydrogen bond: AH:XH:YH3 complexes for A, X = 19F, 35Cl and Y = 15N, 31P.
The journal of physical chemistry. A 2005;109(10):2350-5.
2005: Rozas Isabel; Alkorta Ibon; Elguero José
Modelling protein-RNA interactions: an electron density study of the guanidinium and formate complexes with RNA bases.
Organic & biomolecular chemistry 2005;3(2):366-71.
2005: Claramunt Rosa M; García M Angeles; López Concepción; Trofimenko Swiatoslaw; Yap Glenn P A; Alkorta Ibon; Elguero José
The tautomerism of 1H-pyrazole-3(5)-(N-tert-butyl)carboxamide in the solid state and in solution.
Magnetic resonance in chemistry : MRC 2005;43(1):89-91.
2004: Alkorta Ibon; Elguero José
A GIAO/DFT study of 1H, 13C and 15N shieldings in amines and its relevance in conformational analysis.
Magnetic resonance in chemistry : MRC 2004;42(11):955-61.
2004: Claramunt Rosa M; López Concepción; Alkorta Ibon; Elguero José; Yang Rong; Schulman Steve
The tautomerism of Omeprazole in solution: a 1H and 13C NMR study.
Magnetic resonance in chemistry : MRC 2004;42(8):712-4.
2004: Dardonville Christophe; Jimeno María Luisa; Alkorta Ibon; Elguero José
Homoheteroaromaticity: the case study of azepine and dibenzazepine.
Organic & biomolecular chemistry 2004;2(11):1587-91.
2004: Jagerovic Nadine; Hernandez-Folgado Laura; Alkorta Ibon; Goya Pilar; Navarro Miguel; Serrano Antonia; Rodriguez de Fonseca Fernando; Dannert M Teresa; Alsasua Angela; Suardiaz Margarita; Pascual David; Martín Maria Isabel
Discovery of 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-3-hexyl-1h-1,2,4-triazole, a novel in vivo cannabinoid antagonist containing a 1,2,4-triazole motif.
Journal of medicinal chemistry 2004;47(11):2939-42.
2004: Del Bene Janet E; Elguero Jose; Alkorta Ibon; Yanez Manuel; Mo Otilia
19F-19F spin-spin coupling constant surfaces for (HF)2 clusters: the orientation and distance dependence of the sign and magnitude of J(F-F).
The Journal of chemical physics 2004;120(7):3237-43.
2004: Frideling Aline; Faure Robert; Galy Jean-Pierre; Kenz Ahmed; Alkorta Ibon; Elguero José
Tetrahydroacridin-9-ones, 9-chlorotetrahydroacridines, 9-amino-tetrahydroacridines and 9-(pyrazol-1-yl)-tetrahydroacridines derived from chiral cyclanones.
European journal of medicinal chemistry 2004;39(1):37-48.
2003: Holschbach Marcus H; Sanz Dionisia; Claramunt Rosa M; Infantes Lourdes; Motherwell Sam; Raithby Paul R; Jimeno María Luisa; Herrero David; Alkorta Ibon; Jagerovic Nadine; Elguero José
Structure of a 4-nitroso-5-aminopyrazole and its salts: tautomerism, protonation, and E/Z isomerism.
The Journal of organic chemistry 2003;68(23):8831-7.
2003: Picazo Oscar; Alkorta Ibon; Elguero José
Large chiral recognition in hydrogen-bonded complexes and proton transfer in pyrrolo[2,3-b]pyrrole dimers as model compounds.
The Journal of organic chemistry 2003;68(19):7485-9.
2003: Jimeno María Luisa; Alkorta Ibon; Cano Carolina; Jagerovic Nadine; Goya Pilar; Elguero José; Foces-Foces Concepción
Fentanyl and its analogue N-(1-phenylpyrazol-3-yl)-N-[1-(2-phenylethyl)-4-piperidyl]propanamide: 1H- and 13C-NMR spectroscopy, X-ray crystallography, and theoretical calculations.
Chemical & pharmaceutical bulletin 2003;51(8):929-34.
2003: Abboud José-Luis M; Koppel Ilmar A; Alkorta Ibon; Della Ernest W; Müller Paul; Dávalos Juan Z; Burk Peeter; Koppel Ivar; Pihl Viljar; Quintanilla Esther
Stereoelectronic, strain, and medium effects on the protonation of cubylamine, a Janus-like base.
Angewandte Chemie (International ed. in English) 2003;42(20):2281-4.
2003: Abboud José-Luis M; Alkorta Ibon; Davalos Juan Z; Müller Paul; Quintanilla Esther; Rossier Jean-Claude
Influence of carbocation stability in the gas phase on solvolytic reactivity: beyond bridgehead derivatives.
The Journal of organic chemistry 2003;68(10):3786-96.
2003: Alkorta Ibon; Elguero Jose; Espinosa Enrique; Mata Ignasi; Molins Elies
Comparison of electron density properties in frozen and relaxed electronic distributions.
Journal of computational chemistry 2003;24(4):416-21.
2003: Alkorta Ibon; Elguero José
The influence of chain elongation on Karplus-type relationships: a DFT study of scalar coupling constants in polyacetylene derivatives.
Organic & biomolecular chemistry 2003;1(3):585-7.
2002: Alkorta Ibon; Rozas Isabel; Elguero José
Interaction of anions with perfluoro aromatic compounds.
Journal of the American Chemical Society 2002;124(29):8593-8.
2002: Del Bene Janet E; Perera S Ajith; Bartlett Rodney J; Elguero José; Alkorta Ibon; López-Leonardo Carmen; Alajarin Mateo
(3h)J((15)N-(31)P) spin-spin coupling constants across N[bond]H....O[bond]P hydrogen bonds.
Journal of the American Chemical Society 2002;124(22):6393-7.
2002: Alkorta Ibon; Elguero Jose
Influence of intermolecular hydrogen bonds on the tautomerism of pyridine derivatives.
The Journal of organic chemistry 2002;67(5):1515-9.
2002: Alkorta Ibon; Elguero Jose
Self-discrimination of enantiomers in hydrogen-bonded dimers.
Journal of the American Chemical Society 2002;124(7):1488-93.
2001: Foces-Foces C; Echevarría A; Jagerovic N; Alkorta I; Elguero J; Langer U; Klein O; Minguet-Bonvehí M; Limbach H H
A solid-state NMR, X-ray diffraction, and ab initio computational study of hydrogen-bond structure and dynamics of pyrazole-4-carboxylic acid chains.
Journal of the American Chemical Society 2001;123(32):7898-906.
2000: Foces-Foces C; Alkorta I; Elguero J
Supramolecular structure of 1H-pyrazoles in the solid state: a crystallographic and ab initio study.
Acta crystallographica. Section B, Structural science 2000;56 ( Pt 6)():1018-28.
2000: Campillo N; García C; Goya P; Alkorta I; Páez J A
Novel bronchodilators: synthesis, transamination reactions, and pharmacology of a series of pyrazino[2,3-c][1,2,6]thiadiazine 2, 2-dioxides.
Journal of medicinal chemistry 2000;43(22):4219-27.
1998: Dardonville C; Rozas I; Alkorta I
Similarity studies on guanidinium, imidazolinium, and imidazolium cations: toward new bradykinin antagonists.
Journal of molecular graphics & modelling 1998;16(3):150-6, 166-7.
1997: Goya P; Campillo N; García-Gómez C; Páez J A; Alkorta I
Heterocyclic structures useful in medicinal chemistry: the case of pyrazino[2,3-c][1,2,6]thiadiazine 2,2-dioxide.
Farmaco (Società chimica italiana : 1989) 1997;52(5):283-7.

Sign-in to see more

Sign-in free and Explore the Exciting World of BiomedExperts:

NetworkView

Ibon Alkorta

Research Profile (preview)

Phenomena

Concepts & Ideas

Chemicals & Drugs

Genes & Molecular Sequences

Activities & Behaviors

Occupations

Procedures

Network (preview)

Publications

Sign in free and see...

Visualized networks:

GeoTargeted Searches:

Research Profiles:

Geonetwork of Ibon Alkorta (preview)

All Publications