Information card for entry 7015336

Structure parameters

• Formula: C100 H92 N6 Nd2 O26 S2
• Calculated formula: C100 H92 N6 Nd2 O26 S2
• Title of publication: Synthesis, crystal structures, luminescent and magnetic properties of homodinuclear lanthanide complexes with a flexible tripodal carboxylate ligand.
• Authors of publication: Zhang, Ai-Jiang; Wang, Ya-Wen; Dou, Wei; Dong, Ming; Zhang, Yan-Ling; Tang, Yu; Liu, Wei-Sheng; Peng, Yu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2844 - 2851
• a: 13.3016 ± 0.0005 Å
• b: 27.1952 ± 0.0012 Å
• c: 16.6339 ± 0.0007 Å
• α: 90°
• β: 105.03 ± 0.002°
• γ: 90°
• Cell volume: 5811.3 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1278
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.1124
• Weighted residual factors for all reflections included in the refinement: 0.127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.839
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No