Information card for entry 7039765

Structure parameters

• Chemical name: 2_NaNO2
• Formula: C28 H39 N6 Na O12
• Calculated formula: C28 H39 N6 Na O12
• Title of publication: Cooperative binding and extraction of sodium nitrite by a ditopic receptor incorporated into a polymeric resin.
• Authors of publication: Ziach, K.; Karbarz, M.; Romański, J
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 29
• Pages of publication: 11639 - 11643
• a: 10.2165 ± 0.0007 Å
• b: 27.998 ± 0.0019 Å
• c: 11.4145 ± 0.0007 Å
• α: 90°
• β: 98.9264 ± 0.0017°
• γ: 90°
• Cell volume: 3225.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0675
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0994
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No