Information card for entry 2227743

Structure parameters

• Chemical name: Bis(tetraphenylarsonium) di-μ-hydroxido-bis[(nitrilotriacetato)cobalt(III)] octahydrate
• Formula: C60 H70 As2 Co2 N2 O22
• Calculated formula: C60 H70 As2 Co2 N2 O22
• SMILES: [As+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.C1(=O)C[N]23CC(=O)O[Co]453(O1)(OC(=O)C2)[OH][Co]1235([N](CC(=O)O1)(CC(=O)O2)CC(=O)O3)[OH]4.O.O.O.O.[As+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.O.O.O.O
• Title of publication: Bis(tetraphenylarsonium) di-μ-hydroxido-bis[(nitrilotriacetato)cobalt(III)] octahydrate
• Authors of publication: Visser, Hendrik G.; Clegg, Jack K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 11
• Pages of publication: m1401 - m1402
• a: 7.328 ± 0.005 Å
• b: 14.491 ± 0.005 Å
• c: 16.564 ± 0.005 Å
• α: 113.555 ± 0.005°
• β: 97.04 ± 0.005°
• γ: 101.152 ± 0.005°
• Cell volume: 1542.4 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0348
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.0982
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes