Information card for entry 7248025

Structure parameters

• Formula: C82 H84 Cu3 N14 O26
• Calculated formula: C82 H82 Cu3 N14 O26
• Title of publication: Construction and catalytic effects of solvent- and metal(ii)-dependent products: the process of transformation of 0D structures into 3D structures
• Authors of publication: Kim, Gyeongmin; Han, Jihun; Kim, Dongwon; Jung, Ok-Sang
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 7
• Pages of publication: 918 - 925
• a: 21.1949 ± 0.0018 Å
• b: 18.9263 ± 0.0018 Å
• c: 22.497 ± 0.002 Å
• α: 90°
• β: 105.855 ± 0.002°
• γ: 90°
• Cell volume: 8681.1 ± 1.4 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1717
• Residual factor for significantly intense reflections: 0.1061
• Weighted residual factors for significantly intense reflections: 0.2706
• Weighted residual factors for all reflections included in the refinement: 0.3305
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No