Information card for entry 4114488

Structure parameters

• Common name: UWFIV224-compound 8b
• Formula: C35 H54 N2 Pt
• Calculated formula: C35 H54 N2 Pt
• SMILES: [PtH]12(N(C(=CC(=[N]1c1c(cc(cc1C)C(C)(C)C)C)C)C)c1c(cc(cc1C)C(C)(C)C)C)[CH2]=[CH]2C(C)(C)C
• Title of publication: β-Diiminate Platinum Complexes for Alkane Dehydrogenation
• Authors of publication: Ulrich Fekl; Werner Kaminsky; Karen I. Goldberg
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 15286 - 15287
• a: 9.622 ± 0.0008 Å
• b: 9.968 ± 0.0011 Å
• c: 18.557 ± 0.003 Å
• α: 81.019 ± 0.008°
• β: 81.772 ± 0.008°
• γ: 69.642 ± 0.006°
• Cell volume: 1640.6 ± 0.4 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0731
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1415
• Goodness-of-fit parameter for significantly intense reflections: 1.01
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No