Information card for entry 7216479

Structure parameters

• Formula: C68 H63 Cu6 N11 O17
• Calculated formula: C68 H63 Cu6 N11 O17
• Title of publication: Delicate modulated assembly of a new kind of trinuclear copper(ii) motif governed by N-containing agents
• Authors of publication: Wu, Shu-Ting; Tang, Hong-Liang; Lu, Shu-Mei; Ye, Qiao-Yan; Huang, Xi-He; Huang, Chang-Cang; Hu, Xiao-Lin; Zheng, Shou-Tian
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 42
• Pages of publication: 9792
• a: 22.533 ± 0.004 Å
• b: 23.066 ± 0.005 Å
• c: 14.201 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7381 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 32
• Hermann-Mauguin space group symbol: P b a 2
• Hall space group symbol: P 2 -2ab
• Residual factor for all reflections: 0.0939
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1312
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 0.85
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No