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Information card for entry 4504231
Preview
| Coordinates | 4504231.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H17 Co0.5 N4 O7 |
|---|---|
| Calculated formula | C12 H17 Co0.5 N4 O7 |
| Title of publication | Dimension Increase via Hydrogen Bonding and Weak Coordination Interactions from Simple Complexes of 2-(Pyridyl)benzimidazole Ligands |
| Authors of publication | Li, Xiang-Ping; Pan, Mei; Zheng, Sheng-Run; Liu, Yong-Ru; He, Qi-Ting; Kang, Bei-Sheng; Su, Cheng-Yong |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2007 |
| Journal volume | 7 |
| Journal issue | 12 |
| Pages of publication | 2481 |
| a | 7.6579 ± 0.0016 Å |
| b | 9.948 ± 0.002 Å |
| c | 11.14 ± 0.002 Å |
| α | 86.299 ± 0.004° |
| β | 71.545 ± 0.004° |
| γ | 81.353 ± 0.004° |
| Cell volume | 795.7 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0695 |
| Residual factor for significantly intense reflections | 0.0504 |
| Weighted residual factors for significantly intense reflections | 0.1296 |
| Weighted residual factors for all reflections included in the refinement | 0.1444 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4504231.cif |
| 120110 | 2014-07-12 | Adding DOIs to range 4/50 structures. | 4504231.cif |
| 44981 | 2012-03-20 | ../uploads/cif-deposit/cod/cif Adding structures of 4504225, 4504226, 4504227, 4504228, 4504229, 4504230, 4504231, 4504232, 4504233, 4504234 via cif-deposit CGI script. |
4504231.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.