Information card for entry 2020996

Structure parameters

• Chemical name: Poly[[bis[μ~2~-2,7-bis(pyridine-4-ylmethyl)benzo[<i>imn</i>][3,8]phenanthroline-1,3,6,8(2<i>H</i>,7<i>H</i>)-tetrone]bis(perchlorato)cadmium(II)] chloroform tetrasolvate]
• Formula: C56 H36 Cd Cl14 N8 O16
• Calculated formula: C56 H36 Cd Cl14 N8 O16
• Title of publication: A two-dimensional Cd^II^ coordination polymer based on naphthalenediimide: synthesis, crystal structure and photochromic properties
• Authors of publication: Liu, Jian-Jun; Dong, Ying; Chen, Li-Zhen; Wang, Ling; Xia, Shu-Biao; Huang, Chang-Cang
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 1
• Pages of publication: 94 - 99
• a: 13.8485 ± 0.0007 Å
• b: 15.0536 ± 0.0006 Å
• c: 16.6819 ± 0.0009 Å
• α: 90°
• β: 109.395 ± 0.006°
• γ: 90°
• Cell volume: 3280.3 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes