Information card for entry 7249527

Structure parameters

• Formula: C51 H55 Cl4 N15 O5 S2 Zn3
• Calculated formula: C51 H55 Cl4 N15 O5 S2 Zn3
• Title of publication: Synthesis, crystal structures and luminescence properties of Zn(ii) and Cd(ii) coordination compounds assembled from flexible bis(quinolyl) ligands with symmetrical spacers: the influence of coordinated anions
• Authors of publication: Zhang, Guoqiang; Pan, Rongkai; Liu, Shenggui; Chen, Huihui
• Journal of publication: CrystEngComm
• Year of publication: 2024
• Journal volume: 26
• Journal issue: 46
• Pages of publication: 6627 - 6639
• a: 13.6636 ± 0.0005 Å
• b: 23.7116 ± 0.0011 Å
• c: 18.948 ± 0.0009 Å
• α: 90°
• β: 100.645 ± 0.0014°
• γ: 90°
• Cell volume: 6033.2 ± 0.5 ų
• Cell temperature: 302 ± 0.1 K
• Ambient diffraction temperature: 302 ± 0.1 K
• Number of distinct elements: 7
• 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: 0.1024
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No