Information card for entry 7019897

Structure parameters

• Formula: C47 H37 N4 O5 Re
• Calculated formula: C47 H37 N4 O5 Re
• Title of publication: Cooperation between metal and ligand in oxygen atom transport by N-confused porphyrin oxorhenium(v) complexes.
• Authors of publication: Yamamoto, Takaaki; Toganoh, Motoki; Furuta, Hiroyuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 30
• Pages of publication: 9154 - 9157
• a: 11.231 ± 0.003 Å
• b: 13.123 ± 0.004 Å
• c: 14.134 ± 0.005 Å
• α: 80.616 ± 0.015°
• β: 71.262 ± 0.011°
• γ: 71.95 ± 0.014°
• Cell volume: 1871 ± 1 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.1473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No