Information card for entry 7702028

Structure parameters

• Formula: C114 H72 N12 O36 Re6
• Calculated formula: C114 H72 N12 O36.416 Re6
• Title of publication: One-pot synthesis of oxamidato-bridged hexarhenium trigonal prisms adorned with ester functionality.
• Authors of publication: Nagarajaprakash, R.; Govindarajan, R.; Manimaran, Bala
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 26
• Pages of publication: 11732 - 11740
• a: 34.648 ± 0.002 Å
• b: 27.6088 ± 0.0013 Å
• c: 14.0477 ± 0.0009 Å
• α: 90°
• β: 101.403 ± 0.007°
• γ: 90°
• Cell volume: 13172.6 ± 1.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/n 1
• Hall space group symbol: -C 2yac
• Residual factor for all reflections: 0.1131
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1562
• Weighted residual factors for all reflections included in the refinement: 0.1779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No