Information card for entry 7037543

Structure parameters

• Formula: C44 H48 Co2 O18
• Calculated formula: C44 H48 Co2 O18
• Title of publication: Two water-bridged cobalt(ii) chains with isomeric naphthoate spacers: from metamagnetic to single-chain magnetic behaviour.
• Authors of publication: Liu, Zhong-Yi; Xia, Yan-Fei; Jiao, Jiao; Yang, En-Cui; Zhao, Xiao-Jun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 46
• Pages of publication: 19927 - 19934
• a: 12.744 ± 0.006 Å
• b: 8.161 ± 0.004 Å
• c: 21.438 ± 0.009 Å
• α: 90°
• β: 92.233 ± 0.006°
• γ: 90°
• Cell volume: 2227.9 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0747
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No