Information card for entry 8105974

Structure parameters

• Formula: C84 H84 Gd2 N12 O24 S6
• Calculated formula: C84 H84 Gd2 N12 O24 S6
• Title of publication: Crystal structure of bis(2,2′-bipyridine-κ2N,N′)-tetrakis(μ2-3-(phenylsulfonamido)propanoato-κ2O:O′)-bis(3-(phenylsulfonamido)propanoato-κ2O,O′)digadolinium(III) – 2,2′-bipyridine (1/1), C84H84Gd2N12O24S6
• Authors of publication: Deng, Tao-Li; Liu, Zheng-Jun; Chen, Xiao-Miao; Liu, Xue-Mei
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 6
• Pages of publication: 1189 - 1191
• a: 9.733 ± 0.002 Å
• b: 11.361 ± 0.0008 Å
• c: 21.497 ± 0.0003 Å
• α: 89.635 ± 0.003°
• β: 82.334 ± 0.003°
• γ: 69.794 ± 0.003°
• Cell volume: 2208.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0706
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0925
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No