Information card for entry 7026517

Structure parameters

• Formula: C36 H51 Cl2 Co2 N2 O13 P3 Sb2
• Calculated formula: C36 H51 Cl2 Co2 N2 O13 P3 Sb2
• SMILES: [Sb]1234(O[Sb]567(c8ccc(cc8)Cl)OP(C(C)(C)C)(=[O][Co]8([n]9ccccc9)[O]=P(C(C)(C)C)(O1)O[Co]([n]1ccccc1)([O]46)([O]=P(C(C)(C)C)(O8)O7)([O]3C)[O]5C)O2)c1ccc(cc1)Cl
• Title of publication: Synthesis and structural and magnetic characterisation of cobalt(ii) complexes of mixed phosphonate-antimonate ligands.
• Authors of publication: Ali, Shoaib; Muryn, Christopher A.; Tuna, Floriana; Winpenny, Richard E. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 40
• Pages of publication: 9588 - 9597
• a: 9.9052 ± 0.0002 Å
• b: 22.5257 ± 0.0005 Å
• c: 20.5666 ± 0.0004 Å
• α: 90°
• β: 91.694 ± 0.002°
• γ: 90°
• Cell volume: 4586.85 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0542
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0676
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No