Information card for entry 4077954

Structure parameters

• Formula: C40 H38 Cl2 Cr O P2 Pt
• Calculated formula: C40 H38 Cl2 Cr O P2 Pt
• SMILES: [Pt]1(Cl)(Cl)[P](c2ccccc2)(c2ccccc2)[c]23[cH]4[Cr]56789%10%11%122([cH]4[cH]5[cH]36)[c]2([cH]%12[cH]%11[cH]%10[cH]9[cH]8[cH]72)[P]1(c1ccccc1)c1ccccc1.O1CCCC1
• Title of publication: Synthesis and Reactivity of Palladium- and Platinum-Bridged Heterobimetallic [3]Trochrocenophanes
• Authors of publication: Braunschweig, Holger; Friedrich, Maria; Radacki, Krzysztof; Wolf, Justin
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 3027
• a: 10.899 ± 0.002 Å
• b: 11.419 ± 0.003 Å
• c: 16.198 ± 0.003 Å
• α: 86.53 ± 0.007°
• β: 70.774 ± 0.008°
• γ: 67.328 ± 0.006°
• Cell volume: 1751.3 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0762
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for significantly intense reflections: 0.1713
• Weighted residual factors for all reflections included in the refinement: 0.1779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No