Information card for entry 4086793

Structure parameters

• Formula: C38 H30 P Rh
• Calculated formula: C38 H30 P Rh
• SMILES: [Rh]1234([P](c5ccccc5)(c5ccccc5)c5c(cccc5)C51c1ccccc1c1c5cccc1)[CH]1=[CH]3C3[CH]4=[CH]2C1C3
• Title of publication: Synthesis, Coordination Properties, and Catalytic Application of Triarylmethane-Monophosphines
• Authors of publication: Iwai, Tomohiro; Tanaka, Ryotaro; Sawamura, Masaya
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 23
• Pages of publication: 3959
• a: 9.4279 ± 0.0015 Å
• b: 14.993 ± 0.002 Å
• c: 19.481 ± 0.003 Å
• α: 90°
• β: 90.405 ± 0.002°
• γ: 90°
• Cell volume: 2753.6 ± 0.7 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No