Information card for entry 7054808

Structure parameters

• Formula: C18 H36 N2 O12 S2
• Calculated formula: C18 H36 N2 O12 S2
• SMILES: S(SCCCNC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)CCCNC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
• Title of publication: Novel bio-friendly and non-toxic thiocarbohydrate stabilizers of gold nanoparticles
• Authors of publication: Adokoh, Christian K.; Obuah, Collins; Kinfe, Henok H.; Zinyemba, Orpah; Darkwa, James
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 7
• Pages of publication: 5249
• a: 11.0828 ± 0.0016 Å
• b: 8.3612 ± 0.0012 Å
• c: 25.823 ± 0.004 Å
• α: 90°
• β: 92.896 ± 0.003°
• γ: 90°
• Cell volume: 2389.8 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.85 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.1343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No