Information card for entry 4312815

Structure parameters

• Formula: C46 H36 Cl5 F4 N8 Rh2
• Calculated formula: C46 H36 Cl5 F4 N8 Rh2
• SMILES: c1cccc2[n]1[Rh]134(Cl)[Rh](N2c2c(cccc2)F)(N(c2cccc[n]12)c1c(cccc1)F)(N(c1cccc[n]31)c1c(cccc1)F)N(c1cccc[n]41)c1c(cccc1)F.C(Cl)Cl.C(Cl)Cl
• Title of publication: Substituent and Isomer Effects on Structural, Spectroscopic, and Electrochemical Properties of Dirhodium(III,II) Complexes Containing Four Identical Unsymmetrical Bridging Ligands
• Authors of publication: Karl M. Kadish; Tuan D. Phan; Lingamallu Giribabu; Eric Van Caemelbecke; John L. Bear
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 8663 - 8673
• a: 15.2139 ± 0.0008 Å
• b: 15.2139 ± 0.0008 Å
• c: 9.6116 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2224.7 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 104
• Hermann-Mauguin space group symbol: P 4 n c
• Hall space group symbol: P 4 -2n
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.048
• Weighted residual factors for all reflections included in the refinement: 0.0541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No