Information card for entry 2010396

Structure parameters

• Formula: C6.5 H13.75 N0.25 Na O6 Si
• Calculated formula: C6.5 H13.75 N0.25 Na O6 Si
• SMILES: C1CO[Si]2(O1)(OCCO2)OCCO.C(#N)C.[Na+]
• Title of publication: Sodium Bis[1,2-ethanediolato(2‒)](hydroxyethoxo)silicate(1‒) Acetonitrile Solvate, Na[Si(C~2~H~4~O~2~)~2~(C~2~H~5~O~2~)].0.25C~2~H~3~N
• Authors of publication: Gainsford, G.J.; Kemmitt, T.; Milestone, N.B.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 1
• Pages of publication: 8 - 10
• a: 15.963 ± 0.004 Å
• b: 15.963 ± 0.004 Å
• c: 8.525 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2172.3 ± 1.1 ų
• Cell temperature: 124 K
• Number of distinct elements: 6
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.033
• Goodness-of-fit parameter for significantly intense reflections: 0.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No