Information card for entry 7222154

Structure parameters

• Formula: C30 H28 Au2 Cl2 N2 S4
• Calculated formula: C30 H28 Au2 Cl2 N2 S4
• SMILES: [Au]12([S]=C(N(Cc3ccccc3)Cc3ccccc3)S1)[S]=C(N(Cc1ccccc1)Cc1ccccc1)S2.[Au](Cl)[Cl-]
• Title of publication: Synthesis, characterization and in vitro cytotoxicity of gold(III) dialkyl/diaryldithiocarbamato complexes
• Authors of publication: Isab, A.; Altaf, Muhammad; Travnicek, Zdenek; Dvořák, Zdeněk; Stoeckli-Evans, Helen; Vanco, Jan
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 10.0213 ± 0.0012 Å
• b: 18.605 ± 0.0017 Å
• c: 9.104 ± 0.0012 Å
• α: 90°
• β: 109.36 ± 0.01°
• γ: 90°
• Cell volume: 1601.4 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0386
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0368
• Weighted residual factors for all reflections included in the refinement: 0.0397
• Goodness-of-fit parameter for all reflections included in the refinement: 0.772
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No