Information card for entry 4327930

Structure parameters

• Formula: C123 H87 Cl2 F36 N17 U2
• Calculated formula: C123 H87 Cl2 F36 N17 U2
• Title of publication: Uranium Pyrrolylamine Complexes Featuring a Trigonal Binding Pocket and Interligand Noncovalent Interactions
• Authors of publication: Andrew J. Lewis; Ursula J. Williams; James M. Kikkawa; Patrick J. Carroll; Eric J. Schelter
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 37 - 39
• a: 12.5198 ± 0.0008 Å
• b: 13.438 ± 0.001 Å
• c: 20.5761 ± 0.0014 Å
• α: 72.021 ± 0.003°
• β: 75.321 ± 0.003°
• γ: 63.759 ± 0.003°
• Cell volume: 2925.5 ± 0.4 ų
• Cell temperature: 143 ± 1 K
• Ambient diffraction temperature: 143 ± 1 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: 0.025
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No