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Information card for entry 8107071
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Coordinates | 8107071.cif |
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Original paper (by DOI) | HTML |
Formula | C32 H37 B Cl N |
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Calculated formula | C32 H37 B Cl N |
Title of publication | Crystal structure of 1-(3-chloropropyl)piperidin-1-ium tetraphenylborate, C32H37BClN |
Authors of publication | Mostafa, Gamal A.E.; Ghabbour, Hazem A. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2016 |
Journal volume | 231 |
Journal issue | 3 |
Pages of publication | 983 - 985 |
a | 15.7303 ± 0.0006 Å |
b | 9.1129 ± 0.0003 Å |
c | 19.9295 ± 0.0008 Å |
α | 90° |
β | 109.143 ± 0.002° |
γ | 90° |
Cell volume | 2698.89 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.074 |
Residual factor for significantly intense reflections | 0.0483 |
Weighted residual factors for significantly intense reflections | 0.1123 |
Weighted residual factors for all reflections included in the refinement | 0.1265 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.961 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
282515 (current) | 2023-04-07 | cif/ Adding structures of 8107071 via cif-deposit CGI script. |
8107071.cif |
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Users of the data should acknowledge the original authors of the
structural data.