Information card for entry 4509801

Structure parameters

• Formula: C74 H89 Cl4 N43 Ni12 O38
• Calculated formula: C74 H60 Cl4 N43 Ni12 O38
• Title of publication: Self-Assembly of Multidecker NiIIClusters from Preformed Ni4Decks
• Authors of publication: Ji, Cong-Min; Yang, Hui-Juan; Zhao, Chong-Chao; Tangoulis, Vassilis; Cui, Ai-Li; Kou, Hui-Zhong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 11
• Pages of publication: 4607
• a: 14.086 ± 0.003 Å
• b: 15.411 ± 0.003 Å
• c: 15.621 ± 0.003 Å
• α: 60.6 ± 0.03°
• β: 77.43 ± 0.03°
• γ: 82.97 ± 0.03°
• Cell volume: 2883 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1464
• Residual factor for significantly intense reflections: 0.0729
• Weighted residual factors for significantly intense reflections: 0.1483
• Weighted residual factors for all reflections included in the refinement: 0.1671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No