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Information card for entry 4088977
Preview
| Coordinates | 4088977.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C57 H81 N O2 P2 Zr |
|---|---|
| Calculated formula | C57 H81 N O2 P2 Zr |
| Title of publication | Reactivity Studies of a Zirconium Methylidene Complex: Group Transfer and Methylenation Reactions |
| Authors of publication | Kurogi, Takashi; Kamitani, Masahiro; Manor, Brian C.; Carroll, Patrick J.; Mindiola, Daniel J. |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 36 |
| Journal issue | 1 |
| Pages of publication | 74 |
| a | 31.3061 ± 0.0015 Å |
| b | 10.346 ± 0.0005 Å |
| c | 16.5525 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5361.2 ± 0.5 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 6 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.089 |
| Residual factor for significantly intense reflections | 0.0552 |
| Weighted residual factors for significantly intense reflections | 0.118 |
| Weighted residual factors for all reflections included in the refinement | 0.1343 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237905 (current) | 2019-11-24 | cif/ Adding structures of 4088975, 4088976, 4088977 via cif-deposit CGI script. |
4088977.cif |
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Users of the data should acknowledge the original authors of the
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