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Information card for entry 1550387
Preview
Coordinates | 1550387.cif |
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Structure factors | 1550387.hkl |
Original IUCr paper | HTML |
Chemical name | 1-Diphenylphosphanyl-2-(diphenylphosphoryl)hydrazine |
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Formula | C24 H22 N2 O P2 |
Calculated formula | C24 H22 N2 O P2 |
SMILES | c1(ccccc1)P(=O)(c1ccccc1)NNP(c1ccccc1)c1ccccc1 |
Title of publication | 1-Diphenylphosphanyl-2-(diphenylphosphoryl)hydrazine |
Authors of publication | Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe |
Journal of publication | IUCrData |
Year of publication | 2018 |
Journal volume | 3 |
Journal issue | 12 |
Pages of publication | x181784 |
a | 8.4464 ± 0.0004 Å |
b | 10.4163 ± 0.0005 Å |
c | 13.488 ± 0.0006 Å |
α | 71.55 ± 0.004° |
β | 76.477 ± 0.004° |
γ | 71.75 ± 0.004° |
Cell volume | 1057.04 ± 0.09 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0467 |
Residual factor for significantly intense reflections | 0.0312 |
Weighted residual factors for significantly intense reflections | 0.0718 |
Weighted residual factors for all reflections included in the refinement | 0.0746 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.891 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
212749 (current) | 2018-12-22 | cif/ hkl/ Adding structures of 1550387 via cif-deposit CGI script. |
1550387.cif 1550387.hkl |
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Users of the data should acknowledge the original authors of the
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