Information card for entry 2006542

Structure parameters

• Formula: C6 H18 N2 O11 S
• Calculated formula: C6 H18 N2 O12 S
• Title of publication: An Assessment of Ionic and Hydrogen Bonding in the Crystal Structure of (<small>DL</small>-Serine. H^+^)~2~.SO~4~^2{-^}.H~2~O
• Authors of publication: Zhang, Hong; Wang, Ximin; Chang, Xienan; Xiao, Weiqiang; Zhang, Kecong; Teo, Boon K.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 1286 - 1288
• a: 10.597 ± 0.002 Å
• b: 21.337 ± 0.002 Å
• c: 5.855 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1323.9 ± 0.4 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 23 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.032
• Goodness-of-fit parameter for significantly intense reflections: 1.95
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No