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Information card for entry 8106786
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| Coordinates | 8106786.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 2,2'-diamino[1,1'-biphenyl]-4,4'-dicarboxylic acid dihydrate |
|---|---|
| Formula | C14 H16 N2 O6 |
| Calculated formula | C14 H16 N2 O6 |
| Title of publication | Crystal structure of 2,2′-diamino-[1,1′-biphenyl]-4,4′-dicarboxylic acid dihydrate, C14H16N2O6 |
| Authors of publication | Dikhtiarenko, Alla; Olivos Suarez, Alma I.; Pustovarenko, Alexey; García-Granda, Santiago; Gascon, Jorge |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 1 |
| Pages of publication | 65 - 67 |
| a | 10.0254 ± 0.0005 Å |
| b | 11.2726 ± 0.0006 Å |
| c | 13.4494 ± 0.0007 Å |
| α | 111.535 ± 0.002° |
| β | 92.068 ± 0.002° |
| γ | 102.644 ± 0.002° |
| Cell volume | 1368.16 ± 0.13 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0728 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.1181 |
| Weighted residual factors for all reflections included in the refinement | 0.1328 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281189 (current) | 2023-03-01 | cif/ Adding structures of 8106786 via cif-deposit CGI script. |
8106786.cif |
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Users of the data should acknowledge the original authors of the
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