Results: 269
Jordi Poater, Miquel Duran, Miquel Solà, Bernard Silvi
Theoretical Evaluation of Electron Delocalization in Aromatic Molecules by Means of Atoms in Molecules (AIM) and Electron Localization Function (ELF) Topological Approaches
Chem. Rev., 2005, 105, 3911-3947
DOI: 10.1021/cr030085x
Mireia Güell, Jordi Poater, Josep M. Luis, Otilia Mó, Manuel Yáñez, Miquel Solà
Aromaticity Analysis of Lithium Cation/ Complexes of Aromatic Systems
ChemPhysChem, 2005, 6, 2552-2561
DOI: 10.1002/cphc.200500216
Anbarasan Kalaiselvan, Ponnambalam Venuvanalingam, Jordi Poater, Miquel Solà
Ab initio and DFT modeling of stereoselective deamination of aziridines by nitrosyl chloride
Int. J. Quantum Chem., 2005, 102, 139-146
DOI: 10.1002/qua.20364
Guillem Portella, Jordi Poater, Josep M. Bofill, Pere Alemany, Miquel Solà
Local Aromaticity of [n]Acenes, [n]Phenacenes, and [n]Helicenes (n = 1−9)
J. Org. Chem., 2005, 70, 2509-2521
DOI: 10.1021/jo0480388
Guillem Portella, Jordi Poater, Josep M. Bofill, Pere Alemany, Miquel Solà
Local Aromaticity of [n]Acenes, [n]Phenacenes, and [n]Helicenes (n = 1−9).
J. Org. Chem., 2005, 70, 4560-4560
DOI: 10.1021/jo0560254
Beatriz M. Illescas, Nazario Martín, Jordi Poater, Miquel Solà, Gemma P. Aguado, Rosa M. Ortuño
Diastereoselective Synthesis of Fulleropyrrolidines from Suitably Functionalized Chiral Cyclobutanes
J. Org. Chem., 2005, 70, 6929-6932
DOI: 10.1021/jo0509197
Jordi Poater, Josep M. Bofill, Pere Alemany, Miquel Solà
Local Aromaticity of the Lowest-Lying Singlet States of [n]Acenes (n = 6−9)
J. Phys. Chem. A, 2005, 109, 10629-10632
DOI: 10.1021/jp055188t
Eduard Matito, Jordi Poater, Miquel Solà, Miquel Duran, Pedro Salvador
Comparison of the AIM Delocalization Index and the Mayer and Fuzzy Atom Bond Orders
J. Phys. Chem. A, 2005, 109, 9904-9910
DOI: 10.1021/jp0538464
Eduard Matito, Miquel Solà, Miquel Duran, Jordi Poater
Comment on the Nature of Bonding in the Thermal Cyclization of (Z)-1,2,4,6-Heptatetraene and Its Heterosubstituted Analogues
J. Phys. Chem. B, 2005, 109, 7591-7593
DOI: 10.1021/jp048033e
Guillem Portella, Jordi Poater, Miquel Solà
Assessment of Clar’s aromatic π‐sextet rule by means of PDI, NICS and HOMA indicators of local aromaticity
J. Phys. Org. Chem., 2005, 18, 785-791
DOI: 10.1002/poc.938