Information card for entry 2311108

Structure parameters

• Chemical name: Dipotassium disulfanilamidate trihydrate
• Formula: C6 H10 K N2 O3.5 S
• Calculated formula: C6 H10 K N2 O3.5 S
• SMILES: c1(ccc(cc1)N)S(=O)(=N)[O-].[K+].O.O
• Title of publication: Dipotassium disulfanilamidate trihydrate.
• Authors of publication: How, Fiona N.-F.; Rahima, Z. A.; Khaledi, Hamid; Mohd Ali, Hapipah
• Journal of publication: Acta crystallographica. Section E, Structure reports online
• Year of publication: 2011
• Journal volume: 67
• Journal issue: Pt 8
• Pages of publication: m1071
• a: 23.8174 ± 0.0004 Å
• b: 10.9141 ± 0.0002 Å
• c: 7.4645 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1940.36 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0154
• Residual factor for significantly intense reflections: 0.0154
• Weighted residual factors for significantly intense reflections: 0.0421
• Weighted residual factors for all reflections included in the refinement: 0.0421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No