Information card for entry 1545181

Structure parameters

• Formula: C2.5 H2.5 Np0.12
• Calculated formula: C2.5 H2.5 Np0.125
• Title of publication: Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
• Authors of publication: Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
• Journal of publication: Chem. Sci.
• Year of publication: 2017
• Journal volume: 8
• Journal issue: 4
• Pages of publication: 2553
• a: 8.598 ± 0.0001 Å
• b: 8.598 ± 0.0001 Å
• c: 10.5541 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 780.22 ± 0.02 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 3
• Space group number: 121
• Hermann-Mauguin space group symbol: I -4 2 m
• Hall space group symbol: I -4 2
• Residual factor for all reflections: 0.0083
• Residual factor for significantly intense reflections: 0.0083
• Weighted residual factors for significantly intense reflections: 0.0187
• Weighted residual factors for all reflections included in the refinement: 0.0187
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No