Information card for entry 4319004

Structure parameters

• Formula: C76.5 H131 Cr2 N O8.5 Se2
• Calculated formula: C76.5 H129 Cr2 N O8.5 Se2
• Title of publication: The Methanol-Methanolate CH3OH...OCH3-Bridging Ligand: Tuning of Exchange Coupling by Hydrogen Bonds in Dimethoxo-Bridged Dichromium(III) Complexes
• Authors of publication: Tapan Kanti Paine; Thomas Weyhermüller; Karl Wieghardt; Phalguni Chaudhuri
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6538 - 6540
• a: 10.2757 ± 0.0008 Å
• b: 29.351 ± 0.003 Å
• c: 13.91 ± 0.01 Å
• α: 90°
• β: 108.88 ± 0.01°
• γ: 90°
• Cell volume: 3970 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.1041
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections: 0.1915
• Weighted residual factors for significantly intense reflections: 0.1285
• Goodness-of-fit parameter for all reflections: 1.052
• Goodness-of-fit parameter for significantly intense reflections: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No