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note
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The difference electron density determination [after refinement taking H into account, which was also localized by difference electron density determination and refined using a riding model] shows two difference peaks in a reasonable O-H distance, also with reasonable intermolecular H-O distances forming hydrogen bonds (to Si-OH in two different molecules). There is a significant gap between those two peaks and the remaining peaks in the difference density map. Using HFIX 87, HFIX 147 and HTAB in the SHELXL-97 refinement two possible H(O) positions, very close to the low localized density peaks, are indicated. This all suggests a disorder (50:50) of the Si-OH group with "flipping" hydrogen bond pattern. In addition, data are collected at 123 K and the quality is "not so bad", which even improves the possibility of localization of disordered H atoms
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