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CIF Information Card
Information card for 7101723
7101722 << 7101723 >> 7101724Preview
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Coordinates |
7101723.cif |
Structure parameters
| Common name | Cyclopentadienyl-1,4,7-triphospha-1,4-bis(2-fluorophenyl)-7- phenyl (5,6),(8,9)dibenzocyclononane iron (ii) tetraphenylborate acetonitrile solvate |
| Chemical name | Cyclopentadienyl-1,4,7-triphospha-1,4-bis(2-fluorophenyl)-7-phenyl [5,6],[8,9]dibenzocyclononane iron (ii) tetraphenylborate acetonitrile solvate |
| Formula | - C63 H53 B F2 Fe N P3 - |
| Calculated formula | - C63 H53 B F2 Fe N P3 - |
| Title of publication | Template synthesis of benzannulated triphosphacyclononanes‒a new class of phosphacrowns via template assisted nucleophilic P-C bond formation. |
| Authors of publication | Albers, Thomas; Edwards, Peter G |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 8 |
| Pages of publication | 858 - 860 |
| a | 11.956 ± 0.002 Å |
| b | 12.718 ± 0.004 Å |
| c | 18.674 ± 0.008 Å |
| α | 69.91 ± 0.02° |
| β | 80.92 ± 0.02° |
| γ | 74.67 ± 0.02° |
| Cell volume | 2564.8 ± 1.4 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0649 |
| Residual factor for observed reflections | 0.0404 |
| Weighted residual factors for the observed reflections | 0.0958 |
| Weighted residual factors for all reflections included in the refinement | 0.1121 |
| Goodness-of-fit parameter for observed reflections | 1.024 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |