Information card for entry 4066212

Structure parameters

• Formula: C40 H62 N2 P2 Pt Si2 Zr
• Calculated formula: C40 H62 N2 P2 Pt Si2 Zr
• SMILES: [Pt]1([P](N([Zr](N([P]1(c1ccccc1)c1ccccc1)C(C)C)(C[Si](C)(C)C)C[Si](C)(C)C)C(C)C)(c1ccccc1)c1ccccc1)(C)C
• Title of publication: Electronic Factors Affecting Metal−Metal Interactions in Early/Late Heterobimetallics: Substituent Effects in Zirconium/Platinum Bis(phosphinoamide) Complexes†
• Authors of publication: Cooper, Benjamin G.; Fafard, Claudia M.; Foxman, Bruce M.; Thomas, Christine M.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 21
• Pages of publication: 5179
• a: 11.1953 ± 0.0006 Å
• b: 20.0505 ± 0.0011 Å
• c: 19.8404 ± 0.0011 Å
• α: 90°
• β: 104.257 ± 0.002°
• γ: 90°
• Cell volume: 4316.4 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0193
• Residual factor for significantly intense reflections: 0.0154
• Weighted residual factors for all reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0368
• Weighted residual factors for all reflections included in the refinement: 0.0393
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No