An ab initio study of the structures and the harmonic and anharmonic stretching force constants of the cyanides HCN, LiCN, FCN, ClCN and isocyanides HNC, LiNC, FNC, ClNC-Reference-Cited by-同舟云学术

An ab initio study of the structures and the harmonic and anharmonic stretching force constants of the cyanides HCN, LiCN, FCN, ClCN and isocyanides HNC, LiNC, FNC, ClNC

Published:1980-10 Issue: Volume:67 Page:107-119
ISSN:0022-2860
Container-title:Journal of Molecular Structure
language:en
Short-container-title:Journal of Molecular Structure

Author:

Schmiedekamp Ann,Bock Charles W.,George Philip

Publisher

Elsevier BV

Subject

Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry

Reference40 articles.

1. Theoretical dipole moment derivatives and force constants for HCN

2. Self‐Consistent Molecular Orbital Methods. V. Ab Initio Calculation of Equilibrium Geometries and Quadratic Force Constants

3. Ab initio force constants for the HCN molecule: SCF and CI results

4. Ab initiocalculation of force constants for the linear molecules HCN, FCN, (CN)2and the ion N2F+

5. Structure, Vibrational Spectra, Dipole Moment, and Stability of Gaseous LiCN and LiNC

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