Information card for entry 7715137

Structure parameters

• Formula: C39 H23 Cd N7 O4 S
• Calculated formula: C39 H23 Cd N7 O4 S
• Title of publication: A dinuclear Cd^II cluster-based stable luminescent metal-organic framework for the consecutive and visual detection of H₂PO₄^- and OCN<sup/>.
• Authors of publication: Lu, Na; Wang, Li; Zheng, Teng-Fei; Peng, Yan; Liu, Sui-Jun; Wen, He-Rui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 5160 - 5166
• a: 9.4237 ± 0.0011 Å
• b: 11.6946 ± 0.0013 Å
• c: 16.103 ± 0.0017 Å
• α: 82.624 ± 0.005°
• β: 83.013 ± 0.005°
• γ: 68.067 ± 0.004°
• Cell volume: 1627.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1718
• Residual factor for significantly intense reflections: 0.1042
• Weighted residual factors for significantly intense reflections: 0.0924
• Weighted residual factors for all reflections included in the refinement: 0.1051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No