Neutral structures with a planar tetracoordinated carbon based on spiropentadiene analogues
- Author
- ESTEVES, Pierre M1 ; FERREIRA, Narciso B. P1 ; CORREA, Rodrigo J1
[1] Instituto de Química, Universidade Federal do Rio de Janeiro, Cidade Universitária, CT Bloco A, 21949-900, Rio de Janeiro-RJ, Brazil - Source
Journal of the American Chemical Society. 2005, Vol 127, Num 24, pp 8680-8685, 6 p ; ref : 36 ref
- CODEN
- JACSAT
- ISSN
- 0002-7863
- Scientific domain
- Biochemistry, molecular biology, biophysics; Chemistry; Organic chemistry; Atomic molecular physics
- Publisher
- American Chemical Society, Washington, DC
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Composé bicyclique Composé polycyclique Délocalisation électronique Etude théorique Hydrocarbure Méthode fonctionnelle densité Méthode orbitale moléculaire Orbitale frontière Spirane Structure géométrique Structure moléculaire Structure électronique Spiro[2.2]pentadiène dérivé Composé organique
- Keyword (en)
- Bicyclic compound Polycyclic compound Electron delocalization Theoretical study Hydrocarbons Density functional method Molecular orbital method Frontier orbital Spiran Geometrical structure Molecular structure Electronic structure Organic compounds
- Keyword (es)
- Compuesto bicíclico Compuesto policíclico Deslocalización electrónica Orbital frontera Espirano Estructura geométrica
- 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) / 001B30A15E Density-functional theory
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 16881284
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
10.1021/ja042971a 
https://dx.doi.org/10.1021/ja042971a
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