Information card for entry 7226580

Structure parameters

• Formula: C15 H26 N2 S4
• Calculated formula: C15 H26 N2 S4
• SMILES: S(C(=S)N1CCC(CC1)C)CSC(=S)N1CCC(C)CC1
• Title of publication: Ag(I), Cu(II), Co(III), Hg(II) complexes and metal assisted products derived from 4-methyl-piperidine-carbodithioate: Synthesis, structures, thermal analysis, redox behaviour and fluorescence properties
• Authors of publication: Bharty, M. K.; Nath, Paras; Singh, Nand Kishor; Maiti, Biswajit; Bharty, A.; Butcher, R. J; Wikaira, Jan L.
• Journal of publication: RSC Advances
• Year of publication: 2016
• Journal volume: 6
• Journal issue: 96
• Pages of publication: 93867 - 93880
• a: 8.8763 ± 0.0015 Å
• b: 10.0172 ± 0.0017 Å
• c: 11.405 ± 0.002 Å
• α: 87.26 ± 0.015°
• β: 74.873 ± 0.016°
• γ: 76.569 ± 0.014°
• Cell volume: 952.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1396
• Residual factor for significantly intense reflections: 0.0936
• Weighted residual factors for significantly intense reflections: 0.3293
• Weighted residual factors for all reflections included in the refinement: 0.3757
• Goodness-of-fit parameter for all reflections included in the refinement: 0.837
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No