Information card for entry 4079554

Structure parameters

• Common name: P-Pt-I
• Formula: C47 H62.5 I P2 Pt Si
• Calculated formula: C47 H62.5 I P2 Pt Si
• Title of publication: Platinum-Conjugated Homo- and Heterobichromophoric Complexes of Tetracene and Pentacene
• Authors of publication: Nguyen, Minh-Hai; Yip, John H. K.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 21
• Pages of publication: 7522
• a: 30.112 ± 0.002 Å
• b: 25.0907 ± 0.0017 Å
• c: 24.4373 ± 0.0019 Å
• α: 90°
• β: 91.597 ± 0.003°
• γ: 90°
• Cell volume: 18456 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0848
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1407
• Goodness-of-fit parameter for all reflections included in the refinement: 0.941
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No