Information card for entry 4319206

Structure parameters

• Formula: C45 H30 Cl N4 Rh
• Calculated formula: C45 H28 Cl0.998 N4 Rh
• Title of publication: Unexpected Reactivity of Rh(TPP)I(CO) toward an Alkoxide in CH2Cl2: Synthesis and Crystal Structure of Rh(TPP)(CH2Cl)
• Authors of publication: James P. Collman; Roman Boulatov
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 560 - 563
• a: 12.1012 ± 0.0006 Å
• b: 12.6451 ± 0.0006 Å
• c: 12.8335 ± 0.0007 Å
• α: 70.605 ± 0.001°
• β: 88.848 ± 0.001°
• γ: 65.654 ± 0.001°
• Cell volume: 1671.97 ± 0.15 ų
• Cell temperature: 273.2 K
• Ambient diffraction temperature: 273.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0679
• Weighted residual factors for all reflections: 0.092
• Goodness-of-fit parameter for all reflections: 1.63
• Goodness-of-fit parameter for all reflections included in the refinement: 1.63
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No