Information card for entry 4114609

Structure parameters

• Chemical name: bis([trans,cis,cis-RuCl2(CO)2(Zn.4'-cis-DpyP)]2) (mu-4'-trans-DpyP)2 solvated cis-DpyP =(5,10-bis(4'pyridyl)-15-20-diphenylporphyrin) trans-DpyP =(5,15-bis(4'pyridyl)-10-20-diphenylporphyrin)
• Formula: C149.5 H125 Cl7 N18 O4 Ru2 Zn2
• Calculated formula: C136 H94 Cl4 N18 O4 Ru2 Zn2
• Title of publication: Metallacycles of Porphyrins as Building Blocks in the Construction of Higher Order Assemblies through Axial Coordination of Bridging Ligands: Solution- and Solid-State Characterization of Molecular Sandwiches and Molecular Wires
• Authors of publication: Elisabetta Iengo; Ennio Zangrando; Romina Minatel; Enzo Alessio
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 1003 - 1013
• a: 11.923 ± 0.004 Å
• b: 21.89 ± 0.004 Å
• c: 27.183 ± 0.006 Å
• α: 69.06 ± 0.02°
• β: 84.87 ± 0.02°
• γ: 89 ± 0.02°
• Cell volume: 6599 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1395
• Residual factor for significantly intense reflections: 0.0972
• Weighted residual factors for significantly intense reflections: 0.2555
• Weighted residual factors for all reflections included in the refinement: 0.2912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No