Information card for entry 2230309

Structure parameters

• Chemical name: Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')terbate(III)
• Formula: C36 H24 Cl Cu N10 O12 Tb
• Calculated formula: C36 H24 Cl Cu N10 O12 Tb
• SMILES: [Cu]12(Cl)([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13.[Tb]12345([O]=N(=O)O1)(ON(=[O]2)=O)(ON(=[O]3)=O)(ON(=[O]4)=O)[n]1cccc2ccc3ccc[n]5c3c12
• Title of publication: Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(II) tetrakis(nitrato-κ^2^<i>O</i>,<i>O</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')terbate(III)
• Authors of publication: Gao, Guo-Ran; Man, Hong-Xue; Xiao, Zhi-Chang; Deng, Yu-Heng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m787 - m788
• a: 10.1556 ± 0.0001 Å
• b: 13.4799 ± 0.0002 Å
• c: 14.771 ± 0.0002 Å
• α: 81.103 ± 0.001°
• β: 75.631 ± 0.001°
• γ: 84.465 ± 0.001°
• Cell volume: 1931.71 ± 0.04 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for significantly intense reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.0779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes