Information card for entry 4082750

Structure parameters

• Formula: C36 H80 Cl2 P4 Rh2
• Calculated formula: C36 H80 Cl2 P4 Rh2
• SMILES: [Rh]12([Cl][Rh]3([Cl]1)[P](C(C)(C)C)(C(C)(C)C)CC[P]3(C(C)(C)C)C(C)(C)C)[P](C(C)(C)C)(C(C)(C)C)CC[P]2(C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis and Reactivity of Three-Coordinate (dtbpe)Rh Silylamides: CO2Bond Cleavage by a Rhodium(I) Disilylamide
• Authors of publication: Whited, Matthew T.; Kosanovich, Alex J.; Janzen, Daron E.
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 6
• Pages of publication: 1416
• a: 11.1131 ± 0.0011 Å
• b: 31.692 ± 0.003 Å
• c: 13.1717 ± 0.0013 Å
• α: 90°
• β: 109.328 ± 0.008°
• γ: 90°
• Cell volume: 4377.6 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• 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: 0.0534
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0635
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No