Information card for entry 4512611

Structure parameters

• Formula: C23 H30 Cd Cl2 N6 O10
• Calculated formula: C23 H30 Cd Cl2 N6 O10
• SMILES: [Cd]123(OCl(=O)(=O)=O)([OH]C)[N](CCC[N]1=C(c1[nH]c4ccccc4[n]21)C)=C(c1[nH]c2c([n]31)cccc2)C.Cl(=O)(=O)(=O)[O-].OC
• Title of publication: Assembly of Binuclear, Tetranuclear, and Multinuclear Complexes from Pincer-Like Mononuclear Metallotectons: Structural Diversity Dependent on Precursors
• Authors of publication: Zheng, Sheng-Run; Pan, Mei; Wu, Kai; Chen, Ling; Jiang, Ji-Jun; Wang, Da-Wei; Shi, Jian-Ying; Su, Cheng-Yong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 2
• Pages of publication: 625
• a: 9.1591 ± 0.0016 Å
• b: 10.5151 ± 0.0013 Å
• c: 15.692 ± 0.003 Å
• α: 81.424 ± 0.013°
• β: 73.713 ± 0.015°
• γ: 87.394 ± 0.013°
• Cell volume: 1434.4 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0697
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0777
• Weighted residual factors for all reflections included in the refinement: 0.0911
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No