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Information card for entry 8101131
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Coordinates | 8101131.cif |
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Formula | C12 H22 N2 O |
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Calculated formula | C12 H22 N2 O |
Title of publication | Crystal structure of 11-methyl-7,11-diazatricyclo[7.3.1.0^2,7^]tridecan- 13-ols, C~12~H~22~N~2~O, solid state conformation of syn- and trans- isomers |
Authors of publication | Lindner, Hans Jörg; Foro, Sabine; Nemes, Péter; Scheiber, Pál |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2001 |
Journal volume | 216 |
Journal issue | 4 |
Pages of publication | 511 - 514 |
a | 21.125 ± 0.003 Å |
b | 14.102 ± 0.002 Å |
c | 20.172 ± 0.004 Å |
α | 90° |
β | 126.45 ± 0.01° |
γ | 90° |
Cell volume | 4833.8 ± 1.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for significantly intense reflections | 0.0537 |
Weighted residual factors for significantly intense reflections | 0.1418 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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