Information card for entry 4510637

Structure parameters

• Common name: Di(theobrominesilver)silver hexahydrogenoctamolybdatochromate
• Chemical name: Di(theobrominesilver)silver hexa-mu3-hydroxo-hexa-mu-oxo- [7-chromiumhexakis(dioxomolybdenum)]ate
• Formula: C14 H26 Ag3 Cr Mo6 N8 O30
• Calculated formula: C14 H22 Ag3 Cr Mo6 N8 O30
• Title of publication: A New Strategy for the Synthetic Assembly of Inorganic‒Organic Silver(I)-Polyoxometalate Hybrid Structures Employing Noncovalent Interactions between Theobromine Ligands
• Authors of publication: Kulikov, Vladislav; Meyer, Gerd
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 7
• Pages of publication: 2916
• a: 28.0789 ± 0.0011 Å
• b: 6.3957 ± 0.0001 Å
• c: 21.3742 ± 0.0008 Å
• α: 90°
• β: 98.857 ± 0.003°
• γ: 90°
• Cell volume: 3792.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0412
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No