Information card for entry 7030440

Structure parameters

• Formula: C41 H46 Cd2 N2 O16
• Calculated formula: C41 H46 Cd2 N2 O16
• Title of publication: Two unprecedented NLO-active coordination polymers constructed by a semi-rigid tetrahedral linker.
• Authors of publication: Liang, Li-Li; Ren, Shi-Bin; Zhang, Jun; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 33
• Pages of publication: 7723 - 7726
• a: 22.5854 ± 0.001 Å
• b: 22.5854 ± 0.001 Å
• c: 8.8962 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4538 ± 0.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1072
• Weighted residual factors for all reflections included in the refinement: 0.1092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No