Information card for entry 7024938

Structure parameters

• Common name: Neptunyl(V) N,N-dimethyl-3-oxa-glutaramate monohydrate
• Formula: C6 H14 N Np O8
• Calculated formula: C6 H4 N Np O8
• Title of publication: Complexation of Np(V) with N,N-dimethyl-3-oxa-glutaramic acid and related ligands: thermodynamics, optical properties and structural aspects.
• Authors of publication: Rao, Linfeng; Tian, Guoxin; Teat, Simon J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 13
• Pages of publication: 3326 - 3330
• a: 7.161 ± 0.002 Å
• b: 16.659 ± 0.005 Å
• c: 9.536 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1137.6 ± 0.6 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0728
• Weighted residual factors for all reflections included in the refinement: 0.0733
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No