Information card for entry 2018974

Structure parameters

• Chemical name: Chlorido(dimethyl 2,2'-bipyridine-4,4'-dicarboxylate-κ^2^<i>N</i>,<i>N</i>')(η^5^-pentamethylcyclopentadienyl)rhodium(III) chloride 1-hydroxypyrrolidine-2,5-dione disolvate
• Formula: C32 H37 Cl2 N4 O10 Rh
• Calculated formula: C32 H37 Cl2 N4 O10 Rh
• SMILES: [Rh]12345(Cl)([c]6([c]1([c]2([c]3([c]46C)C)C)C)C)[n]1ccc(cc1c1[n]5ccc(c1)C(=O)OC)C(=O)OC.N1(C(=O)CCC1=O)O.ON1C(=O)CCC1=O.[Cl-]
• Title of publication: Chlorido(dimethyl 2,2'-bipyridine-4,4'-dicarboxylate-κ^2^<i>N</i>,<i>N</i>')(η^5^-pentamethylcyclopentadienyl)rhodium(III) chloride 1-hydroxypyrrolidine-2,5-dione disolvate
• Authors of publication: Sivanesan, Dharmalingam; Kim, Hyung Min; Sungho, Yoon
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: 584 - 587
• a: 8.6511 ± 0.0007 Å
• b: 33.613 ± 0.003 Å
• c: 11.9147 ± 0.0009 Å
• α: 90°
• β: 92.723 ± 0.002°
• γ: 90°
• Cell volume: 3460.8 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1048
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0892
• Goodness-of-fit parameter for all reflections included in the refinement: 0.849
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes