Information card for entry 4129238

Structure parameters

• Common name: {[PhBP3]CoOSiPh3}{BPh4}
• Formula: C88.5 H79 B2 Cl1.5 Co O P3 Si
• Calculated formula: C88.5 H79 B2 Cl3 Co O P3 Si
• Title of publication: Spin-state tuning at pseudotetrahedral d(7) ions: examining the structural and magnetic phenomena of four-coordinate [BP3]CoII-X systems.
• Authors of publication: Jenkins, David M.; Peters, Jonas C.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Journal issue: 19
• Pages of publication: 7148 - 7165
• a: 13.592 ± 0.002 Å
• b: 14.814 ± 0.002 Å
• c: 19.251 ± 0.003 Å
• α: 72.567 ± 0.003°
• β: 87.945 ± 0.003°
• γ: 82.565 ± 0.002°
• Cell volume: 3667.1 ± 0.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1658
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1381
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No