Information card for entry 4337417

Structure parameters

• Formula: C161.5 H174 Mo4 N2 O35.5 P2
• Calculated formula: C161.598 H147.43 Mo4 N2 O35.436 P2
• Title of publication: Synthesis, Structure and Cation-Binding Properties of Some [4 + 4] Metallocyclic MO2(2+) (M = Mo or W) Derivatives of 9-Phenyl-2,3,7-trihydroxyfluor-6-one.
• Authors of publication: McCormick, Laura J.; Abrahams, Brendan F.; Boughton, Berin A.; Grannas, Martin J.; Hudson, Timothy A.; Robson, Richard
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1721 - 1728
• a: 18.8383 ± 0.0012 Å
• b: 20.1833 ± 0.0014 Å
• c: 22.3973 ± 0.0015 Å
• α: 87.328 ± 0.001°
• β: 88.31 ± 0.001°
• γ: 66.96 ± 0.001°
• Cell volume: 7827.5 ± 0.9 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1467
• Residual factor for significantly intense reflections: 0.0791
• Weighted residual factors for significantly intense reflections: 0.2043
• Weighted residual factors for all reflections included in the refinement: 0.2276
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No