Information card for entry 4121221

Structure parameters

• Formula: C20 H40 Cl N P2 Rh
• Calculated formula: C20 H40 Cl N P2 Rh
• SMILES: C(C)(C)(C)[P]1(C(C)(C)C)C=CN2[Rh]1([P](C(C)(C)C)(C(C)(C)C)C=C2)Cl
• Title of publication: Synthesis and Reactivity of a Transient, Terminal Nitrido Complex of Rhodium
• Authors of publication: Markus G. Scheibel; Yanlin Wu; A. Claudia Stückl; Lennard Krause; Elena Carl; Dietmar Stalke; Bas de Bruin; Sven Schneider
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 17719 - 17722
• a: 11.452 ± 0.002 Å
• b: 8.527 ± 0.002 Å
• c: 13.432 ± 0.003 Å
• α: 90°
• β: 113.31 ± 0.02°
• γ: 90°
• Cell volume: 1204.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections included in the refinement: 0.0481
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes