Information card for entry 2213766

Structure parameters

• Chemical name: <i>trans</i>-Tetraaquabis(1,3-di-4-pyridylpropane-κ<i>N</i>)cobalt(II) naphthalene-1,5-disulfonate monohydrate
• Formula: C36 H44 Co N4 O11 S2
• Calculated formula: C36 H46 Co N4 O12 S2
• Title of publication: <i>trans</i>-Tetraaquabis(1,3-di-4-pyridylpropane-κ<i>N</i>)cobalt(II) naphthalene-1,5-disulfonate monohydrate
• Authors of publication: Han, Ke-Fei; Chen, He-Yan; Wang, Zhong-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1695 - m1696
• a: 11.844 ± 0.002 Å
• b: 8.3912 ± 0.0017 Å
• c: 20.035 ± 0.004 Å
• α: 90°
• β: 97.56 ± 0.03°
• γ: 90°
• Cell volume: 1973.9 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.058
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.1016
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes