Information card for entry 1571730

Structure parameters

• Formula: C40 H60 Os4 Th
• Calculated formula: C40 H60 Os4 Th
• SMILES: [Th]([Os]1234[c]5([c]4([c]3([c]2([c]15C)C)C)C)C)([Os]1234[c]5([c]1([c]2([c]3([c]45C)C)C)C)C)([Os]1234[c]5([c]1([c]2([c]3([c]45C)C)C)C)C)[Os]1234[c]5([c]4([c]3([c]2([c]15C)C)C)C)C
• Title of publication: Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes.
• Authors of publication: Ye, Christopher Z.; Del Rosal, Iker; Kelly, Sheridon N.; Brackbill, I. Joseph; Maron, Laurent; Camp, Clément; Arnold, John
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 25
• Pages of publication: 9784 - 9792
• a: 23.163 ± 0.002 Å
• b: 12.6413 ± 0.0011 Å
• c: 15.781 ± 0.0013 Å
• α: 90°
• β: 91.796 ± 0.003°
• γ: 90°
• Cell volume: 4618.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.7288 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No