Information card for entry 7104011

Structure parameters

• Formula: C46.25 H89.5 Cl2 N17 Ni4 O10.75 S8
• Calculated formula: C46.25 H89.5 Cl2 N17 Ni4 O10.75 S8
• Title of publication: Tetranuclear nickel(II) complexes with genuine μ3-1,1,3 and μ4-1,1,3,3 azide bridges
• Authors of publication: Meyer, Franc; Kircher, Peter; Pritzkow, Hans
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 6
• Pages of publication: 774 - 775
• a: 21.14 ± 0.004 Å
• b: 16.348 ± 0.003 Å
• c: 22.316 ± 0.005 Å
• α: 90°
• β: 113.59 ± 0.03°
• γ: 90°
• Cell volume: 7068 ± 2 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0839
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No