Information card for entry 7034018

Structure parameters

• Formula: C82 H88 Cd2 N10 O14
• Calculated formula: C82 H88 Cd2 N10 O14
• Title of publication: Chiral crystallization and optical properties of three metal complexes based on two non-centrosymmetric tripodal ligands.
• Authors of publication: Zhang, Ming-Dao; Shi, Zhi-Qiang; Chen, Min-Dong; Zheng, He-Gen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 12
• Pages of publication: 5818 - 5825
• a: 10.971 ± 0.003 Å
• b: 12.137 ± 0.003 Å
• c: 15.696 ± 0.004 Å
• α: 89.991 ± 0.002°
• β: 90.03 ± 0.001°
• γ: 112.009 ± 0.003°
• Cell volume: 1937.7 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.0706
• Weighted residual factors for significantly intense reflections: 0.1836
• Weighted residual factors for all reflections included in the refinement: 0.1853
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No