Information card for entry 7711432

Structure parameters

• Formula: C24 H48 Cl4 Gd2 N4 O20
• Calculated formula: C24 H48 Cl4 Gd2 N4 O20
• Title of publication: Effective mitigation of gadolinium deposition using the bidentate hydroxypyridinone ligand Me-3,2-HOPO.
• Authors of publication: Sun, Qiwen; Wang, Xiaomei; Shi, Cen; Guan, Jingwen; Chen, Lanhua; Wang, Yumin; Wang, Shuao; Diwu, Juan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 34
• Pages of publication: 13055 - 13060
• a: 9.9405 ± 0.0004 Å
• b: 10.7661 ± 0.0004 Å
• c: 11.2466 ± 0.0004 Å
• α: 102.225 ± 0.001°
• β: 90.625 ± 0.001°
• γ: 115.296 ± 0.001°
• Cell volume: 1056.5 ± 0.07 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0353
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No