Information card for entry 1572499

Structure parameters

• Formula: C70 H84 Cu13 F6 N3 O10
• Calculated formula: C70 H84 Cu13 F6 N3 O10
• Title of publication: Structural diversity of copper(i) alkynyl cluster-based coordination polymers utilizing bifunctional pyridine carboxylic acid ligands
• Authors of publication: Liu, Zheng; Fang, Jun-Jie; Wang, Zhi-Yi; Xie, Yun-Peng; Lu, Xing
• Journal of publication: Nanoscale
• Year of publication: 2024
• Journal volume: 16
• Journal issue: 38
• Pages of publication: 17817 - 17824
• a: 13.1388 ± 0.0012 Å
• b: 13.5488 ± 0.0015 Å
• c: 14.2759 ± 0.0013 Å
• α: 62.883 ± 0.003°
• β: 80.888 ± 0.003°
• γ: 70.396 ± 0.003°
• Cell volume: 2130.8 ± 0.4 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 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: 0.1227
• Residual factor for significantly intense reflections: 0.0772
• Weighted residual factors for significantly intense reflections: 0.2312
• Weighted residual factors for all reflections included in the refinement: 0.2662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No