Information card for entry 7226584

Structure parameters

• Formula: C14 H24 Cu N2 S4
• Calculated formula: C14 H24 Cu N2 S4
• SMILES: [Cu]12([S]=C(S1)N1CCC(CC1)C)[S]=C(S2)N1CCC(CC1)C
• 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: 8.4525 ± 0.0003 Å
• b: 18.6204 ± 0.0006 Å
• c: 12.1412 ± 0.0004 Å
• α: 90°
• β: 106.579 ± 0.004°
• γ: 90°
• Cell volume: 1831.45 ± 0.11 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No