Information card for entry 2237414

Structure parameters

• Chemical name: Hexaaquacobalt(II) 2,2'-[naphthalene-1,8-diylbis(oxy)]diacetate dihydrate
• Formula: C14 H26 Co O14
• Calculated formula: C14 H26 Co O14
• SMILES: c1ccc(c2cccc(c12)OCC(=O)[O-])OCC(=O)[O-].[OH2][Co]([OH2])([OH2])([OH2])([OH2])[OH2].O.O
• Title of publication: Hexaaquacobalt(II) 2,2'-[naphthalene-1,8-diylbis(oxy)]diacetate dihydrate
• Authors of publication: Shi, Hui Fang; Wu, Tao; Jiang, Peng Gang; Hao, Zhi; Zhang, Miao Miao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 2
• Pages of publication: m103 - m104
• a: 6.377 ± 0.002 Å
• b: 6.642 ± 0.002 Å
• c: 12.979 ± 0.005 Å
• α: 79.669 ± 0.01°
• β: 79.963 ± 0.011°
• γ: 64.911 ± 0.008°
• Cell volume: 486.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.032
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes