Information card for entry 7210930

Structure parameters

• Formula: C20 H52 Co2 N8 O2 S6 Sn2
• Calculated formula: C20 H52 Co2 N8 O2 S6 Sn2
• SMILES: O.[S-][Sn]1([S-])S[Sn]([S-])([S-])S1.C1C[NH]2CCC[NH]3[Co]42[NH]1CCC[NH]4CC3.[Co]123[NH]4CC[NH]2CCC[NH]1CC[NH]3CCC4.O
• Title of publication: A new synthetic approach to force bond formation between a transition metal complex and a thiostannate anion: solvothermal synthesis and crystal structure of [Co2(cyclam)2Sn2S6]·2H2O
• Authors of publication: Zeisler, Christoph; Näther, Christian; Bensch, Wolfgang
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 44
• Pages of publication: 8874
• a: 9.0686 ± 0.0006 Å
• b: 9.8673 ± 0.0007 Å
• c: 10.1779 ± 0.0008 Å
• α: 96.769 ± 0.006°
• β: 94.398 ± 0.006°
• γ: 102.954 ± 0.006°
• Cell volume: 876.36 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.052
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No