Information card for entry 4000889

Structure parameters

• Formula: C15.43 H25.71 Cl0.57 Co2 N1.71 O10.86
• Calculated formula: C15.4286 H25.7143 Cl0.571429 Co2 N1.71429 O10.8571
• SMILES: [O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.C[N]1=Cc2cccc3c2[O]2[Co]4561[O](C)c1c7[O]4[Co]489([OH]5[Co]5%10%11%12[OH]6[Co]6%132([N](C)=Cc2c%14[O]%13[Co]%13%15([OH]56)([OH]%12[Co]56%12([OH]%10[Co]%10%16([O]4c4c([O]8C)cccc4C=[N]%10C)([OH]9%11)[O](C)c4c([O]5%16)c(C=[N]6C)ccc4)[O]%15c4c([O]%12C)cccc4C=[N]%13C)[O](c%14ccc2)C)[O]3C)[N](C)=Cc7ccc1.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Traditional and Microwave-Assisted Solvothermal Synthesis and Surface Modification of Co7Brucite Disk Clusters and Their Magnetic Properties
• Authors of publication: Zhou, Yan-Ling; Zeng, Ming-Hua; Wei, Lian-Qiang; Li, Bin-Wen; Kurmoo, Mohamedally
• Journal of publication: Chemistry of Materials
• Year of publication: 2010
• Journal volume: 22
• Journal issue: 14
• Pages of publication: 4295
• a: 14.0445 ± 0.0008 Å
• b: 14.0445 ± 0.0008 Å
• c: 23.235 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3969 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1479
• Weighted residual factors for all reflections included in the refinement: 0.1603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No