Information card for entry 4310237

Structure parameters

• Chemical name: bis[trans,cis,cis-dichloro-dicarbonyl- bis(ethanol-zinc(II)-5,10-bis(3'-pyridyl)-15,20-diphenyl-porphyrinato)- -ruthenium(II)] chloroform solvate
• Formula: C95 H67 Cl13 N12 O6 Ru2 Zn2
• Calculated formula: C95 H67 Cl13 N12 O6 Ru2 Zn2
• Title of publication: Pyridylporphyrin Metallacycles with a Slipped Cofacial Geometry: Spectroscopic, X-ray, and Photophysical Characterization
• Authors of publication: Elisabetta Iengo; Ennio Zangrando; Marco Bellini; Enzo Alessio; Anna Prodi; Claudio Chiorboli; Franco Scandola
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9752 - 9762
• a: 15.873 ± 0.004 Å
• b: 18.597 ± 0.005 Å
• c: 19.372 ± 0.005 Å
• α: 65.88 ± 0.02°
• β: 85.53 ± 0.02°
• γ: 78.18 ± 0.02°
• Cell volume: 5108 ± 2 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: 0.1202
• Residual factor for significantly intense reflections: 0.0983
• Weighted residual factors for significantly intense reflections: 0.2713
• Weighted residual factors for all reflections included in the refinement: 0.2976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No