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Information card for entry 8107245
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Coordinates | 8107245.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H34 N2 |
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Calculated formula | C23 H34 N2 |
Title of publication | Crystal structure of N 2,N 4-dimesitylpentane-2,4-diamine, C23H34N2 |
Authors of publication | Wallach, Christoph; Klein, Wilhelm; Fässler, Thomas F. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2022 |
Journal volume | 237 |
Journal issue | 5 |
Pages of publication | 893 - 895 |
a | 15.2448 ± 0.0011 Å |
b | 8.2189 ± 0.0005 Å |
c | 16.735 ± 0.0016 Å |
α | 90° |
β | 103.133 ± 0.007° |
γ | 90° |
Cell volume | 2042 ± 0.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 3 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0651 |
Residual factor for significantly intense reflections | 0.0438 |
Weighted residual factors for significantly intense reflections | 0.1189 |
Weighted residual factors for all reflections included in the refinement | 0.1277 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
283938 (current) | 2023-05-22 | cif/ Adding structures of 8107245 via cif-deposit CGI script. |
8107245.cif |
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Users of the data should acknowledge the original authors of the
structural data.