Information card for entry 7038249

Structure parameters

• Formula: C40 H80 Cl5 N4 P4 Rh
• Calculated formula: C40 H80 Cl5 N4 P4 Rh
• Title of publication: Transition metal (Rh and Fe) complexes and main-group (Se and B) adducts with N,N'-diphosphanyl NHC ligands: a study of stereoelectronic properties.
• Authors of publication: Ai, Pengfei; Danopoulos, Andreas A.; Braunstein, Pierre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 11
• Pages of publication: 4771 - 4779
• a: 14.6459 ± 0.0012 Å
• b: 15.1086 ± 0.0013 Å
• c: 15.817 ± 0.0013 Å
• α: 88.107 ± 0.002°
• β: 64.451 ± 0.002°
• γ: 72.376 ± 0.002°
• Cell volume: 2990.1 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1111
• Residual factor for significantly intense reflections: 0.0699
• Weighted residual factors for significantly intense reflections: 0.1933
• Weighted residual factors for all reflections included in the refinement: 0.2111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No