The use of recently avaiktble frequency, "C frequency shift, Coriolis coupling, and centrift& distortion data enables the GHFF offormnldchyde to be determined with same degree of precision. Excellent agreement is obtained between the experimentally determined interaction force constants and those pr
The harmonic force field of methanol
β Scribed by P.D. Mallinson
- Publisher
- Elsevier Science
- Year
- 1975
- Tongue
- English
- Weight
- 408 KB
- Volume
- 58
- Category
- Article
- ISSN
- 0022-2852
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
The complete general harmonic force field of methyl chloride has been recalculated using the most recent literature frequency, Coriolis zeta, and centrifugal distortion data for (12)CH(3)(35)Cl, (13)CH(3)(35)Cl, (12)CD(3)(35)Cl, (12)CHD(2)(35)Cl, (12)CH(2)D(35)Cl, (12)CH(3)(37)Cl, (12)CD(3)(37)Cl, (
The molecular geometry and the harmonic and the anharmonic components of the force field of FSN have been evaluated by the SCF and, to account for electron correlation, by the MP2 and CASSCF methods. Comparison with experiment of the theoretical geometry, dipole and force constants shows that SCF an