Information card for entry 2218769

Structure parameters

• Chemical name: Diaquabis[2-(benzyloxy)acetato]cobalt(II)
• Formula: C18 H22 Co O8
• Calculated formula: C18 H22 Co O8
• SMILES: C1(=O)C[O](Cc2ccccc2)[Co]2(O1)(OC(=O)C[O]2Cc1ccccc1)([OH2])[OH2]
• Title of publication: Diaquabis[2-(benzyloxy)acetato]cobalt(II)
• Authors of publication: Chen, Chun-Liang; Sun, Sheng-Li; Gu, Chang-Sheng; Song, Weng-Dong; Hao, Xiao-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m890
• a: 11.4968 ± 0.0001 Å
• b: 7.1557 ± 0.0001 Å
• c: 12.0054 ± 0.0001 Å
• α: 90°
• β: 109.708 ± 0.001°
• γ: 90°
• Cell volume: 929.803 ± 0.018 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0264
• Residual factor for significantly intense reflections: 0.0234
• Weighted residual factors for significantly intense reflections: 0.0636
• Weighted residual factors for all reflections included in the refinement: 0.0658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes