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Information card for entry 7701898
Preview
| Coordinates | 7701898.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H100 F12 N8 O4 P4 |
|---|---|
| Calculated formula | C76 H100 F12 N8 O4 P4 |
| Title of publication | First entry into nonmetal-centred porphycenes: synthesis of a phosphorus(v) complex of octaethylporphycene. |
| Authors of publication | Abe, Masaaki; Mukotaka, Hiroto; Fujioka, Taro; Okawara, Toru; Umegaki, Kei; Ono, Toshikazu; Hisaeda, Yoshio |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2018 |
| Journal volume | 47 |
| Journal issue | 8 |
| Pages of publication | 2487 - 2491 |
| a | 14.105 ± 0.002 Å |
| b | 14.414 ± 0.002 Å |
| c | 18.746 ± 0.003 Å |
| α | 72.154 ± 0.002° |
| β | 87.487 ± 0.002° |
| γ | 87.452 ± 0.002° |
| Cell volume | 3622.4 ± 0.9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0905 |
| Residual factor for significantly intense reflections | 0.0482 |
| Weighted residual factors for significantly intense reflections | 0.0938 |
| Weighted residual factors for all reflections included in the refinement | 0.1098 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227800 (current) | 2019-11-15 | cif/ Adding structures of 7701898, 7701899 via cif-deposit CGI script. |
7701898.cif |
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Users of the data should acknowledge the original authors of the
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