Information card for entry 1569806

Structure parameters

• Formula: C92 H112 N2 O12 Zn3
• Calculated formula: C92 H112 N2 O12 Zn3
• Title of publication: Zinc(II) and Copper(II) Complexes of 4-Styrylpyridine and 1-Adamantanecarboxylic Acid: Syntheses, Crystal Structures, and Photopolymerization
• Authors of publication: Lee, Dong Hee; An, Jaewook; Oh, Jihye; Park, In-Hyeok
• Journal of publication: Crystals
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 1226
• a: 12.2791 ± 0.0003 Å
• b: 12.5594 ± 0.0003 Å
• c: 14.265 ± 0.0003 Å
• α: 92.774 ± 0.001°
• β: 115.24 ± 0.001°
• γ: 92.827 ± 0.001°
• Cell volume: 1981.6 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0988
• Residual factor for significantly intense reflections: 0.0912
• Weighted residual factors for significantly intense reflections: 0.2742
• Weighted residual factors for all reflections included in the refinement: 0.2819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No