Information card for entry 4306551

Structure parameters

• Formula: C12 H8 Cl8 Ga2 N2 S2 Te2
• Calculated formula: C12 H8 Cl8 Ga2 N2 S2 Te2
• SMILES: [Te]12Sc3ccccc3N1[Te]1Sc3ccccc3N12.Cl[Ga]([Cl-])(Cl)Cl.Cl[Ga]([Cl-])(Cl)Cl
• Title of publication: Heavy Atom Analogues of 1,2,3-Dithiazolylium Salts: Preparation, Structures and Redox Chemistry
• Authors of publication: Maarit Risto; Abdeljalil Assoud; Stephen M. Winter; Raija Oilunkaniemi; Risto S. Laitinen; Richard T. Oakley
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 10100 - 10109
• a: 7.7297 ± 0.0009 Å
• b: 9.7183 ± 0.0005 Å
• c: 9.8185 ± 0.0005 Å
• α: 116.053 ± 0.001°
• β: 99.39 ± 0.001°
• γ: 95.522 ± 0.001°
• Cell volume: 641.9 ± 0.09 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 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: 0.0238
• Residual factor for significantly intense reflections: 0.0201
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No