A theoretical study of anion-π interactions in seven-membered rings
- Author
- QUINONERO, David1 ; FRONTERA, Antonio1 ; ESCUDERO, Daniel1 ; BALLESTER, Pablo2 ; COSTA, Antonio1 ; DEYA, Pere M1
[1] Department de Quimica, Universitat de les Illes Balears, Crta. de Valldemossa km 7.5, 07122 Palma de Mallorca, Baleares, Spain
[2] ICREA and Institut Catala d'Investigació Química (ICIQ), Avinguda Països Catalans 16, 43009 Tarragona, Spain - Source
ChemPhysChem (Print). 2007, Vol 8, Num 8, pp 1182-1187, 6 p ; ref : 37 ref
- Publisher
- Wiley, Weinheim
- Publication country
- Germany
- Document type
- Article
- Language
- English
- Author keyword
- ab initio calculations anion-pi bonding molecular recognition noncovalent interactions pi interactions
- Keyword (fr)
- Anion minéral Calcul ab initio Cation organique Composé cyclique insaturé Cycle 7 chaînons Etat solide Etude théorique Interaction intermoléculaire Interaction moléculaire Interaction électrostatique Potentiel interaction Reconnaissance moléculaire Structure géométrique Système électron pi 3115A 3170 Tropylium
- Keyword (en)
- Inorganic anion Ab initio calculations Organic cation Unsaturated cyclic compound Seven membered ring Solid state Theoretical study Intermolecular interaction Molecular interaction Electrostatic interaction Interaction potentials Molecular recognition Geometrical structure Pi electron system
- Keyword (es)
- Anión inorgánico Catión orgánico Compuesto cíclico insaturado Ciclo 7 eslabones Estado sólido Interacción intermolecular Interacción molecular Interacción electrostática Reconocimiento molecular Estructura geométrica Sistema electrón pi
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A15 Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) / 001B30A15A Ab initio calculations
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A70 Effects of atomic and molecular interactions on electronic structure
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 18803380
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1002/cphc.200700100 
https://dx.doi.org/10.1002/cphc.200700100
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