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Information card for entry 7244602
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Coordinates | 7244602.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Diphenylphosphinic acid |
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Formula | C12 H11 O2 P |
Calculated formula | C12 H11 O2 P |
Title of publication | Self-association of diphenylpnictoginic acids in solution and solid state: covalent vs hydrogen bonding |
Authors of publication | Yakubenko, Artyom A.; Puzyk, Aleksandra M.; Korostelev, Vladislav O.; Mulloyarova, Valeriia V.; Tupikina, Elena Yu.; Tolstoy, Peter; Antonov, Alexander S. |
Journal of publication | Physical Chemistry Chemical Physics |
Year of publication | 2022 |
a | 11.4435 ± 0.0003 Å |
b | 5.9428 ± 0.0002 Å |
c | 15.6087 ± 0.0004 Å |
α | 90° |
β | 100.199 ± 0.002° |
γ | 90° |
Cell volume | 1044.72 ± 0.05 Å3 |
Cell temperature | 100 ± 0.3 K |
Ambient diffraction temperature | 100 ± 0.3 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0388 |
Residual factor for significantly intense reflections | 0.0344 |
Weighted residual factors for significantly intense reflections | 0.088 |
Weighted residual factors for all reflections included in the refinement | 0.0912 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7244602.html
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