Information card for entry 2015216

Structure parameters

• Chemical name: Di-μ-chloro-bis{bis[2,5-bis(4-methoxyphenyl)-1,3,4-oxadiazole- κ^2^C~2~,N]iridium(III)] dichloromethane disolvate
• Formula: C66 H56 Cl6 Ir2 N8 O12
• Calculated formula: C66 H56 Cl6 Ir2 N8 O12
• Title of publication: Di-μ-chloro-bis{bis[2,5-bis(4-methoxyphenyl)-1,3,4-oxadiazole- κ^2^<i>C</i>~2~,<i>N</i>]iridium(III)] dichloromethane disolvate
• Authors of publication: Chen, Lian-Qing; Yang, Chu-Luo; Qin, Jin-Gui
• Journal of publication: Acta Crystallographica, Section C
• Year of publication: 2005
• Journal volume: 61
• Pages of publication: m513 - m515
• a: 11.5352 ± 0.001 Å
• b: 23.39 ± 0.002 Å
• c: 25.239 ± 0.002 Å
• α: 90°
• β: 98.423 ± 0.002°
• γ: 90°
• Cell volume: 6736.2 ± 1 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 6
• 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: 0.0712
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.1221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No