Information card for entry 7122191

Structure parameters

• Formula: C8 H24 Cl5 N4 Np O2
• Calculated formula: C8 H24 Cl5 N4 Np O2
• Title of publication: Impacts of oxo interactions within actinyl metal organic materials: Highlight on thermal expansion behaviour
• Authors of publication: Payne, Maurice K.; Pyrch, Mikaela; Jubinsky, Matthew; Basile, Madeline; Forbes, Tori
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 7.4041 ± 0.001 Å
• b: 10.4454 ± 0.0011 Å
• c: 12.3566 ± 0.0016 Å
• α: 76.494 ± 0.01°
• β: 89.313 ± 0.009°
• γ: 71.795 ± 0.007°
• Cell volume: 880.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0103
• Residual factor for significantly intense reflections: 0.0102
• Weighted residual factors for significantly intense reflections: 0.0247
• Weighted residual factors for all reflections included in the refinement: 0.025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.324
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No