Information card for entry 4506833

Structure parameters

• Formula: C60 H37 Gd3 N13 O21
• Calculated formula: C60 H36 Gd3 N13 O21
• Title of publication: Highly Thermostable One-Dimensional Lanthanide(III) Coordination Polymers Constructed from Benzimidazole-5,6-dicarboxylic Acid and 1,10-Phenanthroline: Synthesis, Structure, and Tunable White-Light Emission
• Authors of publication: Ma, Xue; Li, Xia; Cha, Yu-E; Jin, Lin-Pei
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 11
• Pages of publication: 5227
• a: 10.9574 ± 0.0011 Å
• b: 21.61 ± 0.002 Å
• c: 24.121 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5711.6 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1142
• Residual factor for significantly intense reflections: 0.0842
• Weighted residual factors for significantly intense reflections: 0.2012
• Weighted residual factors for all reflections included in the refinement: 0.2265
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No