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Molecular structure and vibrational analysis of 2-vinyl furan

Author
GIULIANI, A1 ; GILBERT, B2 ; KECH, C3 ; HUBIN-FRANSKIN, M.-J1
[1] Laboratoire de Spectroscopie d'Électrons Diffusés, Université de Liège, Institut de Chimie Bât. B6c, 4000 Liège, Belgium
[2] Chimie Analytique et Electrochimie, Institut de Chimie Bât. B6c, Université de Liège, 4000 Liège, Belgium
[3] Centre de Recherches du Cyclotron, Université de Liège Bât., B30, Allée du 6 août no. 8, 4000 Liège, Belgium
Source

Chemical physics letters. 2003, Vol 379, Num 5-6, pp 406-411, 6 p ; ref : 18 ref

CODEN
CHPLBC
ISSN
0009-2614
Scientific domain
General chemistry, physical chemistry; Atomic molecular physics; Condensed state physics
Publisher
Elsevier Science, Amsterdam
Publication country
Netherlands
Document type
Article
Language
English
Keyword (fr)
Analyse vibrationnelle Angle liaison Calcul MNDO Composé organique Conformation Furane dérivé Hétérocycle oxygène Longueur liaison Mode vibration Méthode AM1 Méthode PM3 Méthode semiempirique Phase liquide Structure moléculaire Furane(2-vinyl)
Keyword (en)
Vibrational analysis Bond angle MNDO calculations Organic compounds Conformation Furan derivatives Heterocyclic oxygen compounds Bond lengths Vibrational modes AM1 calculations PM3 calculations Semiempirical method Liquid phase Molecular structure
Keyword (es)
Análisis vibracional Conformación Furano derivado Método semiempírico
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) / 001B30A15C Semi-empirical and empirical calculations (differential overlap, hückel, ppp methods, etc.)

Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30C Molecular properties and interactions with photons / 001B30C15 Properties of molecules and molecular ions / 001B30C15B General molecular conformation and symmetry; stereochemistry

Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30C Molecular properties and interactions with photons / 001B30C20 Molecular spectra / 001B30C20T Vibrational analysis

Pacs
3115B Statistical model calculations (including Thomas-Fermi and Thomas-Fermi-Dirac models)

Pacs
3315B General molecular conformation and symmetry; stereochemistry

Pacs
3320T Vibrational analysis

Discipline
Atomic and molecular physics
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
15156875

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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