Information card for entry 2223474

Structure parameters

• Chemical name: Dichlorido(2,9-dipropoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)
• Formula: C18 H20 Cd Cl2 N2 O2
• Calculated formula: C18 H20 Cd Cl2 N2 O2
• SMILES: [Cd]1([n]2c(OCCC)ccc3ccc4ccc([n]1c4c23)OCCC)(Cl)Cl
• Title of publication: Dichlorido(2,9-dipropoxy-1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)
• Authors of publication: Niu, Cao-Yuan; Zheng, Xian-Fu; Dang, Yu-Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: m1245
• a: 31.3159 ± 0.001 Å
• b: 31.3159 ± 0.001 Å
• c: 8.1662 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8008.5 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0643
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.0875
• Weighted residual factors for all reflections included in the refinement: 0.1014
• 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: Yes