Information card for entry 7042053

Structure parameters

• Formula: C80 H84 N4 O8 U2
• Calculated formula: C80.82 H62 N8 O7.83 U2
• Title of publication: F-element metalated dipyrrins: synthesis and characterization of a family of uranyl bis(dipyrrinate) complexes.
• Authors of publication: Bolotaulo, Duer; Metta-Magaña, Alejandro; Fortier, Skye
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 10
• Pages of publication: 3284 - 3294
• a: 14.4946 ± 0.0005 Å
• b: 15.8228 ± 0.0005 Å
• c: 16.5676 ± 0.0005 Å
• α: 98.766 ± 0.001°
• β: 102.554 ± 0.001°
• γ: 96.958 ± 0.001°
• Cell volume: 3618.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0763
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1339
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No