Information card for entry 4340675

Structure parameters

• Formula: C27 H69 K N4 Si7 U
• Calculated formula: C27 H69 K N4 Si7 U
• SMILES: [U]1([N]([Si](C)(C)C)([Si](C)(C)C)[K]23456(N1[Si](C)(C)C)[CH]1=[CH]6[CH]5=[CH]4[CH]3=[CH]21)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Anomalous one-electron processes in the chemistry of uranium nitrogen multiple bonds.
• Authors of publication: Mullane, Kimberly C.; Lewis, Andrew J.; Yin, Haolin; Carroll, Patrick J.; Schelter, Eric J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 17
• Pages of publication: 9129 - 9139
• a: 19.4433 ± 0.0007 Å
• b: 19.632 ± 0.0007 Å
• c: 23.2293 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8866.9 ± 0.5 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections included in the refinement: 0.0595
• Goodness-of-fit parameter for all reflections included in the refinement: 1.221
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No