Information card for entry 4346556

Structure parameters

• Common name: [DMPyr]4Te12
• Chemical name: Tetra(dimethylpyrrolidinium)-dodecatelluride
• Formula: C24 H56 N4 Te12
• Calculated formula: C24 H56 N4 Te12
• SMILES: C1CCC[N+]1(C)C.C1CCC[N+]1(C)C.[Te]1[Te][Te]2[Te][Te][Te]2[Te][Te][Te]2[Te][Te][Te]12.C1CCC[N+]1(C)C.C1CCC[N+]1(C)C
• Title of publication: Synthesis of organic (trimethylsilyl)chalcogenolate salts Cat[TMS-E] (E = S, Se, Te): the methylcarbonate anion as a desilylating agent.
• Authors of publication: Finger, Lars H.; Scheibe, Benjamin; Sundermeyer, Jörg
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 19
• Pages of publication: 9568 - 9575
• a: 9.5497 ± 0.0007 Å
• b: 18.7183 ± 0.0014 Å
• c: 13.2276 ± 0.001 Å
• α: 90°
• β: 107.817 ± 0.002°
• γ: 90°
• Cell volume: 2251.1 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.03
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections included in the refinement: 0.063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.291
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No