Information card for entry 7109959

Structure parameters

• Formula: C62 H59 Cu4 I4 O9.86 P4
• Calculated formula: C62 H59 Cu4 I4 O9.86 P4
• Title of publication: A solid AND logic stimuli-responsive material with bright nondestructive performance designed by sensitive cuprophilicity
• Authors of publication: Xiao-Chen Shan; Fei-Long Jiang; Hua-bin Zhang; Xiang-Ying Qian; Lian Chen; Ming-Yan Wu; Shaeel A. AL-Thabaiti; Mao-Chun Hong
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 10227
• a: 12.7974 ± 0.0016 Å
• b: 13.9384 ± 0.0019 Å
• c: 22.801 ± 0.002 Å
• α: 93.117 ± 0.004°
• β: 91.872 ± 0.004°
• γ: 113.996 ± 0.006°
• Cell volume: 3703.4 ± 0.8 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0827
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1488
• Weighted residual factors for all reflections included in the refinement: 0.1687
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No