Information card for entry 7009247

Structure parameters

• Common name: compound 5b(Ni)
• Formula: C39 H66 Cl2 Co2 Ni2 O20 P6
• Calculated formula: C39 H48 Cl2 Co2 Ni2 O20 P6
• Title of publication: An entry to half-sandwich complexes of first row transition metals (Ni, Co, Mn) containing the Kläui tripodal ligand, LOMe: synthesis and crystal structures of oligomeric, [LOMeM(μ-X)(L)]n (n = 2, 4), and monomeric complexes, LOMeM(L2)(X)
• Authors of publication: De-qiang Ma; Shiro Hikichi; Munetaka Akita; Yoshihiko Moro-oka
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2000
• Journal issue: 7
• Pages of publication: 1123 - 1134
• a: 19.103 ± 0.005 Å
• b: 14.8 ± 0.002 Å
• c: 21.34 ± 0.002 Å
• α: 90°
• β: 113.253 ± 0.003°
• γ: 90°
• Cell volume: 5543.3 ± 1.7 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1703
• Weighted residual factors for all reflections included in the refinement: 0.174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.419
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No