Experimental and ab-initio calculated vcd spectra of the first OH-stretching overtone of (lR)-(-) and (1S)-(+)-endo-BORNEOL
- Author
- GANGEMI, Fabrizio1 2 ; GANGEMI, Roberto1 2 ; LONGHI, Giovanna1 2 ; ABBATE, Sergio1 2
[1] Dipartimento di Scienze Biomediche e Biotecnologie, Viale Europa 11, 25123 Brescia, Italy
[2] Consorzio Nazionale Interuniversilario per le Scienze Fisiche della Materia, Via delta Vasca Navale, 84, 00146 Roma, Italy - Source
PCCP. Physical chemistry chemical physics (Print). 2009, Vol 11, Num 15, pp 2683-2689, 7 p ; ref : 26 ref
- Publisher
- Royal Society of Chemistry, Cambridge
- Publication country
- United Kingdom
- Document type
- Article
- Language
- English
- Keyword (fr)
- Absorption IR Bornéol Calcul ab initio Constante anharmonicité Dichroïsme circulaire Dipôle Enantiomère Etude théorique Fonction onde Fonctionnelle densité Fréquence Longueur liaison Mode vibration Méthode fonctionnelle densité Solution diluée 3115A 3115E Terpène
- Keyword (en)
- Infrared absorption Borneol Ab initio calculations Anharmonicity constant Circular dichroism Dipole Enantiomer Theoretical study Wave function Density functional Frequency Bond length Vibrational mode Density functional method Dilute solution Terpene
- Keyword (es)
- Absorción IR Borneol Constante anarmonicidad Dicroismo circular Dipolo Enantiómero Estudio teórico Función onda Funciónal densidad Frecuencia Longitud enlace Modo de vibración Solución diluida Terpeno
- Classification
- Discipline
- General chemistry and physical chemistry
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 21371163
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
10.1039/b818432a 
https://dx.doi.org/10.1039/b818432a
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