Information card for entry 2201642

Structure parameters

• Chemical name: [RhCl~3~{2,6-bis(3,4-dihydro-2H-pyrrol-5-yl)pyridine}] benzene solvate
• Formula: C25 H27 Cl3 N3 Rh
• Calculated formula: C25 H27 Cl3 N3 Rh
• SMILES: C1CCC2c3cccc4[n]3[Rh]([N]1=2)(Cl)([N]1CCCC4=1)(Cl)Cl.c1ccccc1.c1ccccc1
• Title of publication: [2,6-Bis(3,4-dihydro-2<i>H</i>-pyrrol-5-yl)pyridine]trichlororhodium(III) dibenzene solvate
• Authors of publication: Cabort, Amel; Therrien, Bruno; Bernauer, Klaus; Süss-Fink, Georg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 10
• Pages of publication: m564 - m565
• a: 11.434 ± 0.002 Å
• b: 10.63 ± 0.002 Å
• c: 20.948 ± 0.004 Å
• α: 90°
• β: 100.12 ± 0.03°
• γ: 90°
• Cell volume: 2506.5 ± 0.8 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.032
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.059
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes