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Sarma (ref 26) have stated that "the hydrogen.in the acid homodimer could not be located from a difference electron density Fourier map". We found that the situation is quite complicated. In many cases, the acid H-atom was located easily in the difference Fourier map. Generally, only a single H-atom position was found rather than two half-H atoms, which would have been suggestive of disorder. However, the two C-O distances in the carboxyl group ranged from an extreme of 1.22, 1.31 to nearly equal distances 1.26, 1.26, showing the full extent of order/disorder of the carboxyl group. Further, the different carboxyl dimers in any one particular structure could also show variability in the disorder
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, pp. 3094-3096
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Custelcean, R.1
Afloroaei, C.2
Vlassa, M.3
Polverejan, M.4
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