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SiH3Br |
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Bromine |
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Nuclear
Quadrupole Coupling Constants |
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in
Silyl Bromide |
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Table 1. Bromine nqcc's in
SiH3Br (MHz). Calculation was made on the equilibrium
structure of Demaisaon et al. [2]. |
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Calc. |
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Expt. [1] |
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79Br |
Xzz |
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337.81 |
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334.981(8) |
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81Br |
Xzz |
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282.23 |
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279.825(5) |
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The difference between calculated and
experimental 79Br
nqcc's is 2.83 MHz (0.84 %). For 81Br, the difference
is
2.41 MHz (0.86 %). |
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Table 2. Structure
parameters, re [2] (Ċ and degrees). |
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SiBr |
2.2070 |
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SiH |
1.4696 |
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BrSiH |
108.38 |
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[1] K.F.Dössel and
D.H.Sutter, Z.Naturforsch. 34a,469(1979); 32a,1444(1977).
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[2] J.Demaison, J.Cosléou,
H.Bürger, and E.B.Mkadmi, J.Mol.Spectrosc. 185,384(1997). |
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H.Bürger, J.Cosléou,
J.Demaison, E.B.Mkadmi, and M.Paplewski, J.Mol.Spectrosc.
182,205(1997). In SiD3Br, eqQo(79Br)
= 334.16(4) MHz and eqQo(81Br) =
280.1(13) MHz. |
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CH3Br |
SiF3Br |
GeH3Br |
CF3Br |
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CH3Cl |
CF3Cl |
SiH3Cl |
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Table of Contents |
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Molecules/Bromine |
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SiH3Br.html |
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Last
Modified 25 Jan 2006 |
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