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Information card for entry 7123248
Preview
| Coordinates | 7123248.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H32 Co N8 O4 |
|---|---|
| Calculated formula | C44 H32 Co N8 O4 |
| Title of publication | Morphology-dependent third-order optical nonlinearity of a 2D Co-based metal−organic framework with a porphyrinic skeleton |
| Authors of publication | Niu, Ru-Jie; Zhou , Wen-Fa; LIU, Yan; Yang, Junyi; Zhang, Wen-Hua; Lang, Jian-Ping; Young, david James |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 9.8838 ± 0.0009 Å |
| b | 9.113 ± 0.0007 Å |
| c | 20.2408 ± 0.0018 Å |
| α | 90° |
| β | 103.771 ± 0.003° |
| γ | 90° |
| Cell volume | 1770.7 ± 0.3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 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 | 0.1266 |
| Residual factor for significantly intense reflections | 0.0648 |
| Weighted residual factors for significantly intense reflections | 0.14 |
| Weighted residual factors for all reflections included in the refinement | 0.1642 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214451 (current) | 2019-04-03 | cif/ Adding structures of 7123247, 7123248 via cif-deposit CGI script. |
7123248.cif |
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Users of the data should acknowledge the original authors of the
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