Information card for entry 4502674

Structure parameters

• Formula: C25 H50 Co Mo7 N10 O32
• Calculated formula: C25 H26 Co Mo7 N10 O32
• SMILES: [Mo]123(O[Co]([n]4cc(ccc4)N)([OH2])([OH2])([OH2])[OH2])(=O)O[Mo]45([O]62[Mo]2(O3)(=O)(=O)O[Mo]37([O]89[Mo]%10(=O)(=O)(O[Mo]8(O4)([O]5[Mo]69(O1)(O%10)[O]27)(=O)=O)O3)(=O)=O)(=O)=O.c1c(cccn1)N.c1c(cccn1)N.c1c(ccc[nH+]1)N.c1c(ccc[nH+]1)N.O.O.O.O
• Title of publication: Polyoxometalate Supported Transition Metal Complexes: Synthesis, Crystal Structures, and Supramolecular Chemistry
• Authors of publication: Arumuganathan, T.; Rao, A. Srinivasa; Das, Samar K.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 4272
• a: 18.175 ± 0.0008 Å
• b: 13.5872 ± 0.0008 Å
• c: 20.3409 ± 0.001 Å
• α: 90°
• β: 96.482 ± 0.001°
• γ: 90°
• Cell volume: 4991 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0545
• Weighted residual factors for all reflections included in the refinement: 0.0546
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No