Information card for entry 7028330

Structure parameters

• Formula: C8 H20 Cl4 Np O4
• Calculated formula: C8 H20 Cl4 Np O4
• SMILES: [Np]12(Cl)(Cl)(Cl)(Cl)([O](C)CC[O]1C)[O](C)CC[O]2C
• Title of publication: Synthesis and characterization of NpCl4(DME)2 and PuCl4(DME)2 neutral transuranic An(IV) starting materials.
• Authors of publication: Reilly, Sean D.; Brown, Jessie L.; Scott, Brian L.; Gaunt, Andrew J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 4
• Pages of publication: 1498 - 1501
• a: 16.509 ± 0.003 Å
• b: 7.2429 ± 0.0012 Å
• c: 14.85 ± 0.003 Å
• α: 90°
• β: 115.662 ± 0.002°
• γ: 90°
• Cell volume: 1600.5 ± 0.5 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 K
• Number of distinct elements: 5
• 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: 0.032
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0408
• Weighted residual factors for all reflections included in the refinement: 0.0433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No