The performance of effective core potentials (ECP) for the main group elements of group IV has been studied by calculating the geometries and reaction energies of isodesmic reactions for the molecules M(CH3)nC14-n (M = C, Si, Ge, Sn, Pb; n = 0-4) at the Hartree-Fock level of theory. The results are
Photoacoustic overtone spectroscopy of M(CH3)4 compounds (M = C, Si, Ge, Sn)
β Scribed by Carlos Manzanares I; N.L.S. Yamasaki; Eric Weitz; J.Thomas Knudtson
- Publisher
- Elsevier Science
- Year
- 1985
- Tongue
- English
- Weight
- 614 KB
- Volume
- 117
- Category
- Article
- ISSN
- 0009-2614
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β¦ Synopsis
The gas-phare fundamental and overlone (o =l-7) spectra of de C-H svelching modes of the series M(CH3), (M = C, Si. Gc, Sn) have been retarded using intramti~y photoacoustic laser spec~~ovopy as well as standard infrared uxhmques. Absorption cross sections have been obtied for u = 5 and 6 of Lhe series. The change m frequency of the transitions and tie mass-dependent changes in imewidth are interpreted in lerms of a local mode description of vibrational overtones ' On ieave from Departamenlo de Quimica, Universidad Simbn Rolivk Aparlado 80659, Caracas 1081. Venezuela ' Prcsenl address: Aerospace Corp.. MS753.
π SIMILAR VOLUMES
The sum of electronic and thermal free energy differences between singlet and triplet states ( G t-s ) is calculated for C 4
Chemical shift and scalar coupling constant information has been obtained from the 'H, -C, 29Si and '19Sn NMR spectra of a series of compounds (CH,),SnCH&I(CH,),, where M = Sn, Ge, Si or C and with one or two CH3-(Sn) groups replaced by C1, Br or I. The (CH,)&I and (CH3)&ICH2 groups appear to have o