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Information card for entry 7206808
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Coordinates | 7206808.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1, 4-bis (diphenylhydroxymethyl) benzene N-methylformamide clathrate |
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Formula | C34 H31 N O3 |
Calculated formula | C34 H31 N O3 |
Title of publication | Inclusion of 1,4-bis(diphenylhydroxymethyl)benzene with amides: structure and selectivity |
Authors of publication | Jacobs, Ayesha; Nassimbeni, Luigi R.; Silwana, Nothemba; Báthori, Nikoletta B.; Weber, Edwin |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 23 |
Pages of publication | 7014 |
a | 8.276 ± 0.0017 Å |
b | 8.992 ± 0.0018 Å |
c | 18.972 ± 0.004 Å |
α | 84.68 ± 0.03° |
β | 89.23 ± 0.03° |
γ | 67.92 ± 0.03° |
Cell volume | 1302.3 ± 0.5 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0694 |
Residual factor for significantly intense reflections | 0.0462 |
Weighted residual factors for significantly intense reflections | 0.1059 |
Weighted residual factors for all reflections included in the refinement | 0.1213 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7206808.html
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