Information card for entry 7219706

Structure parameters

• Common name: [Co28(C40H44S4O4)6(C2N3H2)16(CO3)Cl11(OH)3(CH3OH)2(H2O)6]
• Formula: C283 H351 Cl11 Co28 N48 O46 S24
• Calculated formula: C275 H302 Cl11 Co28 N48 O38 S24
• Title of publication: Constructing calixarene-supported high nuclearity Co27, Co28and Ni18Na6clusters with triazoles as co-bridges
• Authors of publication: Wang, Shentang; Bi, Yanfeng; Liao, Wuping
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 14
• Pages of publication: 2896
• a: 37.033 ± 0.007 Å
• b: 45.29 ± 0.009 Å
• c: 24.166 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 40532 ± 14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0998
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.1919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No