Information card for entry 2201831

Structure parameters

• Chemical name: Bis[2,2'-(2-aminoethylimino)di(ethylammonium)] hexasulfidoditin dihydrate
• Formula: C12 H44 N8 O2 S6 Sn2
• Calculated formula: C12 H44 N8 O2 S6 Sn2
• SMILES: O.C(CN)N(CC[NH3+])CC[NH3+].[S-][Sn]1([S-])S[Sn]([S-])(S1)[S-].O.C(CN)N(CC[NH3+])CC[NH3+]
• Title of publication: Bis[2,2'-(2-aminoethylimino)di(ethylammonium)] hexasulfidodistannate(IV) dihydrate
• Authors of publication: Näther, Christian; Scherb, Sandra; Bensch, Wolfgang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 5
• Pages of publication: m280 - m282
• a: 7.7499 ± 0.0015 Å
• b: 9.7054 ± 0.0019 Å
• c: 10.908 ± 0.002 Å
• α: 89.22 ± 0.03°
• β: 75.27 ± 0.03°
• γ: 67.4 ± 0.03°
• Cell volume: 729.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.353
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes