๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Deuterium quadrupole coupling constant in CD2Cl2

โœ Scribed by M.P. Klein; D. Gill; G. Kotowycz

Book ID
107731159
Publisher
Elsevier Science
Year
1968
Tongue
English
Weight
172 KB
Volume
2
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.

๐Ÿ“œ SIMILAR VOLUMES

The Cl Nuclear Quadrupole Coupling Tenso
The Cl Nuclear Quadrupole Coupling Tensor of Dichlorosilane, SiH2Cl2
โœ K.D. Hensel; W. Jager; M.C.L. Gerry; I. Merke ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 420 KB

The \(b\)-type rotational spectrum of \({ }^{28} \mathrm{SiH}_{2}{ }^{35} \mathrm{Cl}_{2}\) has been remeasured in the frequency region 10.3-15.7 GHz \((J=1-10)\) using a microwave Fourier transform (MWFT) cavity spectrometer. The MWFT technique has permitted resolution of the complex hyperfine patt

B3LYP Calculation of Deuterium Quadrupol
B3LYP Calculation of Deuterium Quadrupole Coupling Constants in Molecules
โœ William C. Bailey ๐Ÿ“‚ Article ๐Ÿ“… 1998 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 107 KB

The B3LYP/6-31G(df,3p) model for the calculation of deuterium nuclear quadrupole coupling constants (nqcc's) is shown to yield results as accurate as calculations previously performed at the MP4 level of theory. For 25 molecules, ranging from HD and DF to pyridine and fluorobenzene, the rms differen