Information card for entry 7027281

Structure parameters

• Formula: C70 H94 Cl10 Cu3 N12 Nd2 O78
• Calculated formula: C70 H94 Cl10 Cu3 N12 Nd2 O78
• Title of publication: Synthesis and structures of carboxylate-bridged polynuclear copper(II)‒lanthanide(III) complexes [CuLn(C5H5N+CH2CO2−)5(H2O)5][ClO4]5·2H2O (Ln = La or Nd) and [Cu3Nd2(C5H5N+CH2CO2−)10(NO3)2(H2O)8][ClO4]10·4H2O
• Authors of publication: Yang, Yang-Yi; Wu, Yu-Luan; Long, La-Sheng; Chen, Xiao-Ming
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 12
• Pages of publication: 2005
• a: 11.41 ± 0.004 Å
• b: 14.992 ± 0.006 Å
• c: 18.447 ± 0.007 Å
• α: 73.38 ± 0.01°
• β: 72.14 ± 0.01°
• γ: 88.9 ± 0.01°
• Cell volume: 2869.8 ± 1.9 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0733
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1212
• Weighted residual factors for all reflections included in the refinement: 0.1344
• 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: Yes
• Has Fobs: No