Information card for entry 7018004

Structure parameters

• Formula: C56 H44 Cd2 N16 O10
• Calculated formula: C56 H40 Cd2 N16 O10
• SMILES: N1(C(=O)c2cccc(N)c2C(=O)N1)[Cd]12([n]3cccc4ccc5ccc[n]1c5c34)N1C(c3cccc(c3C(=O)N1)N)O[Cd]1(N3C(c4cccc(c4C(=O)N3)N)O2)(N2NC(=O)c3c(cccc3N)C2=O)[n]2cccc3ccc4ccc[n]1c4c23.O.O
• Title of publication: New photoluminescence acylhydrazidate-coordinated complexes.
• Authors of publication: Jin, Juan; Bai, Fu-Quan; Jia, Ming-Jun; Peng, Yu; Yu, Jie-Hui; Xu, Ji-Qing
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 8
• Pages of publication: 2382 - 2392
• a: 24.837 ± 0.005 Å
• b: 10.147 ± 0.002 Å
• c: 20.137 ± 0.004 Å
• α: 90°
• β: 96.51 ± 0.03°
• γ: 90°
• Cell volume: 5042.2 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No