Information card for entry 7005883

Structure parameters

• Formula: C60 H93 Ga2 N6 O0.5 Zn
• Calculated formula: C60 H93 Ga2 N6 O0.5 Zn
• Title of publication: Synthesis and characterisation of zinc gallyl complexes: first structural elucidations of Zn-Ga bonds.
• Authors of publication: Jones, Cameron; Rose, Richard P.; Stasch, Andreas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 28
• Pages of publication: 2997 - 2999
• a: 13.953 ± 0.003 Å
• b: 21.07 ± 0.004 Å
• c: 46.243 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13595 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1774
• Residual factor for significantly intense reflections: 0.1271
• Weighted residual factors for significantly intense reflections: 0.3003
• Weighted residual factors for all reflections included in the refinement: 0.3198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No