Information card for entry 4341738

Structure parameters

• Formula: C47.5 H61 B2 N12 S3 U
• Calculated formula: C47.5 H57 B2 N12 S3 U
• Title of publication: Trivalent Uranium Phenylchalcogenide Complexes: Exploring the Bonding and Reactivity with CS2in the Tp*2UEPh Series (E = O, S, Se, Te)
• Authors of publication: Matson, Ellen M.; Breshears, Andrew T.; Kiernicki, John J.; Newell, Brian S.; Fanwick, Phillip E.; Shores, Matthew P.; Walensky, Justin R.; Bart, Suzanne C.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2014
• Pages of publication: 141121084824006
• a: 11.2943 ± 0.0005 Å
• b: 14.3126 ± 0.0005 Å
• c: 17.4998 ± 0.0008 Å
• α: 72.318 ± 0.002°
• β: 74.613 ± 0.003°
• γ: 69.986 ± 0.003°
• Cell volume: 2490.96 ± 0.19 ų
• Cell temperature: 150 ± 0.2 K
• Ambient diffraction temperature: 150 ± 0.2 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: 0.039
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CU-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No