Information card for entry 4316990

Structure parameters

• Common name: Neptunium 1,2-Phenyldiphosphonate
• Formula: C12 H8 Np O14 P4
• Calculated formula: C12 H8 Np O14 P4
• Title of publication: Cerium(IV), Neptunium(IV), and Plutonium(IV) 1,2-Phenylenediphosphonates: Correlations and Differences between Early Transuranium Elements and Their Proposed Surrogates
• Authors of publication: Juan Diwu; Shuao Wang; Zuolei Liao; Peter C. Burns; Thomas E. Albrecht-Schmitt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 10074 - 10080
• a: 7.8855 ± 0.0011 Å
• b: 9.8628 ± 0.0013 Å
• c: 12.8105 ± 0.0018 Å
• α: 100.644 ± 0.002°
• β: 95.617 ± 0.002°
• γ: 102.669 ± 0.001°
• Cell volume: 945.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0359
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No