Information card for entry 4074829

Structure parameters

• Formula: C112 H84 Cl2 N8 O8 P4 Rh2
• Calculated formula: C112 H84 Cl2 N8 O8 P4 Rh2
• SMILES: c1(ccccc1)[P]1([C@@H](N2N([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)c1ccccc1)[Rh]1([P]2(c3ccccc3)[C@@H](N3N(C(=O)c4c(C3=O)cccc4)[C@H]2c2ccccc2)c2ccccc2)[Cl][Rh]([P]2(c3ccccc3)[C@H](c3ccccc3)N3N(C(=O)c4c(C3=O)cccc4)[C@H]2c2ccccc2)([P]2(c3ccccc3)[C@@H](N3N(C(=O)c4c(C3=O)cccc4)[C@H]2c2ccccc2)c2ccccc2)[Cl]1
• Title of publication: Synthesis, Characterization, and Transition-Metal Complexes of 3,4-Diazaphospholanes
• Authors of publication: Landis, Clark R.; Nelson, Ryan C.; Jin, Wiechang; Bowman, Amanda C.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 6
• Pages of publication: 1377 - 1391
• a: 16.2011 ± 0.0012 Å
• b: 16.2011 ± 0.0012 Å
• c: 47.347 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12427.4 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.1216
• Residual factor for significantly intense reflections: 0.0873
• Weighted residual factors for significantly intense reflections: 0.2333
• Weighted residual factors for all reflections included in the refinement: 0.2727
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No