Information card for entry 4308050

Structure parameters

• Common name: CLUSTER-2
• Chemical name: Cluster Co-Hg-Te
• Formula: C108 H60 Cl4 Co Hg8 N6 O6 Te13
• Calculated formula: C108 H60 Cl4 Co Hg8 N6 O6 Te13
• SMILES: [Co]([O]=CN(C)C)([O]=CN(C)C)([O]=CN(C)C)([O]=CN(C)C)([O]=CN(C)C)[O]=CN(C)C.Cl[Hg]12[Te](c3ccccc3)[Hg]34[Te]56[Hg]7([Te](c8ccccc8)[Hg](Cl)([Te]3c3ccccc3)[Te]([Hg]35[Te](c5ccccc5)[Hg](Cl)([Te]([Hg]6([Te](c5ccccc5)[Hg](Cl)([Te]3c3ccccc3)[Te]4c3ccccc3)[Te]2c2ccccc2)c2ccccc2)[Te]7c2ccccc2)c2ccccc2)[Te]1c1ccccc1
• Title of publication: Mercury Bis(phenyltellurolate) as a Precursor for the Synthesis of Binary and Ternary Nanoclusters
• Authors of publication: Davi F. Back; Gelson N. M. de Oliveira; Robert A. Burrow; Ernesto E. Castellano; Ulrich Abram; Ernesto S. Lang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 2356 - 2358
• a: 28.6613 ± 0.0009 Å
• b: 28.6613 ± 0.0009 Å
• c: 28.6613 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 23544.4 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 219
• Hermann-Mauguin space group symbol: F -4 3 c
• Hall space group symbol: F -4a 2 3
• Residual factor for all reflections: 0.0597
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.32
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No