Information card for entry 4063235

Structure parameters

• Common name: [Ca(thf){N(SiMe3)2}(MesNPPh2CHPPh2NMes)]
• Formula: C53 H69 Ca N3 O P2 Si2
• Calculated formula: C53 H69 Ca N3 O P2 Si2
• Title of publication: Synthesis and M-Cγ Hemilability of Group 2 Bis(phosphinimino)methanides
• Authors of publication: Shabana A. Ahmed; Michael S. Hill; Peter B. Hitchcock
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 2
• Pages of publication: 394 - 402
• a: 12.6861 ± 0.0006 Å
• b: 22.9406 ± 0.0011 Å
• c: 18.2982 ± 0.001 Å
• α: 90°
• β: 104.334 ± 0.002°
• γ: 90°
• Cell volume: 5159.5 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1741
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.1423
• Weighted residual factors for all reflections included in the refinement: 0.1722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No