Information card for entry 4339853

Structure parameters

• Chemical name: mer-tricarbonylchlorobis(4-[2,2']bithiophenyl-5-yl-pyridine)rhenium(I)
• Formula: C21.5 H17 Cl0.5 N O1.5 Re0.5 S2
• Calculated formula: C14.5 H9 Cl0.5 N O1.5 Re0.5 S2
• Title of publication: Electrochromic polymer films containing Re(I) and Pt(II) metal centers.
• Authors of publication: Farrell, Joshua R.; Lavoie, David P.; Pennell, Ryan T.; Cetin, Anil; Shaw, Janet L.; Ziegler, Christopher J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 17
• Pages of publication: 6840 - 6842
• a: 16.742 ± 0.005 Å
• b: 9.043 ± 0.003 Å
• c: 26.653 ± 0.008 Å
• α: 90°
• β: 103.926 ± 0.005°
• γ: 90°
• Cell volume: 3917 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0454
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0764
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No