Information card for entry 1520391

Structure parameters

• Formula: C37 H60 Cl Fe O4 P2 Rh
• Calculated formula: C37 H60 Cl Fe O4 P2 Rh
• SMILES: [CH]12=[CH]3C4[CH]5=[CH](C1C4)[Rh]1235[P]([c]23[c]4(C)[c]5([c]6(C)[c]2(C)[Fe]27893456[c]3([c]2([c]7(C)[c]8([c]93C)C)C)[P]1(C(C)C)C(C)C)C)(C(C)C)C(C)C.[O-]Cl(=O)(=O)=O
• Title of publication: C37H60ClFeO4P2Rh
• Authors of publication: Coles, Simon J.; Hursthouse, Michael B.; Butler, I. R.
• Journal of publication: Crystal Structure Report Archive
• Year of publication: 2009
• Pages of publication: 654
• a: 16.8121 ± 0.0012 Å
• b: 19.229 ± 0.002 Å
• c: 22.968 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7425.1 ± 1.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No