Information card for entry 7109688

Structure parameters

• Formula: C42 H36 Cl5 Co F6 N12 Ni P Rh
• Calculated formula: C42 H36 Cl5 Co F6 N12 Ni P Rh
• SMILES: c1cccc2[n]1[Rh]134([Co]5678N2c2cccc[n]2[Ni]6([n]2c(N5c5[n]1cccc5)cccc2)([n]1c(cccc1)N7c1cccc[n]31)[n]1c(N8c2[n]4cccc2)cccc1)Cl.[P](F)(F)(F)(F)(F)[F-].C(Cl)Cl.C(Cl)Cl
• Title of publication: Facile synthesis of heterotrimetallic metal-string complex [NiCoRh(dpa)4Cl2] through direct metal replacement
• Authors of publication: Ming-Chuan Cheng; Chi-Lun Mai; Chen-Yu Yeh; Gene-Hsiang Lee; Shie-Ming Peng
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 7938
• a: 18.73 ± 0.001 Å
• b: 17.2013 ± 0.0008 Å
• c: 15.5306 ± 0.0008 Å
• α: 90°
• β: 110.081 ± 0.003°
• γ: 90°
• Cell volume: 4699.5 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• 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: 0.085
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1364
• Weighted residual factors for all reflections included in the refinement: 0.1533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No