Pt. Brain et al., DETERMINATION BY ELECTRON-DIFFRACTION OF THE MOLECULAR-STRUCTURE OF BROMOTRIS(METHOXYDIMETHYLSILYL)METHANE IN THE GAS-PHASE, Journal of the Chemical Society. Dalton transactions, (6), 1995, pp. 975-978
The molecular structure of bromotris(methoxydimethylsilyl) methane in
the gas phase has been determined by electron diffraction. The molecul
es have C, symmetry, adopting a conformation in which the Si-O bonds a
re gauche with respect to the C-Br bond, and the O-C bonds are anti wi
th respect to the inner Si-C bonds. This arrangement avoids conflict b
etween the sterically demanding methoxydimethylsilyl groups and minimi
ses interactions between lone pairs of electrons on the methoxy groups
, which are widely separated from each other, on the periphery of the
molecule. The Br-C-Si-O and C-inner-Si-O-C dihedral angles are 38.5(5)
and 169.9(28)degrees respectively. Other principal parameters (r(a))
are r(C-Br) 196.0(21) pm, r(Si-C-inner) 190.6(10) pm, r(Si-C-outer) 18
8.3(4) pm, r(Si-O) 167.4(4) pm, r(O-C) 141.9(5) pm, and angles Br-C-Si
106.2(6)degrees, C-inner-Si-C-outer 114.7(5)degrees, C-inner-Si-O 107
.3(9)degrees, C-outer-Si-O 106.4(8)degrees and Si-O-C 121.4(13)degrees
.