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Information card for entry 4060127
Preview
| Coordinates | 4060127.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53.85 H53.55 Cl0.15 N4 P2 Ti |
|---|---|
| Calculated formula | C53.85 H53.55 Cl0.15 N4 P2 Ti |
| Authors of publication | Rainer Vollmerhaus; Robert Tomaszewski; Pengcheng Shao; Nicholas J. Taylor; Kevin J. Wiacek; Stewart P. Lewis; Abdulaziz Al-Humydi; Scott Collins |
| Journal of publication | Organometallics |
| Year of publication | 2005 |
| a | 20.36 ± 0.003 Å |
| b | 20.087 ± 0.002 Å |
| c | 22.375 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 9151 ± 2 Å3 |
| Cell temperature | 160 ± 2 K |
| Ambient diffraction temperature | 160 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0569 |
| Residual factor for significantly intense reflections | 0.0421 |
| Weighted residual factors for significantly intense reflections | 0.0906 |
| Weighted residual factors for all reflections included in the refinement | 0.0914 |
| Goodness-of-fit parameter for all reflections included in the refinement | 2.254 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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