Information card for entry 2014307

Structure parameters

• Chemical name: molybdenum(VI) tricopper(II) tellurium(IV) heptaoxide dichloride hemihydrate
• Formula: C7 H Cu3 Mo O7.5 Te
• Calculated formula: Cl2 Cu3 H Mo O7.5 Te
• Title of publication: MoCu~3~TeO~7~Cl~2~·0.5H~2~O
• Authors of publication: Takagi, Rie; Fabienne Duc; Johnsson, Mats; molybdenum(VI) tricopper(II) tellurium(IV) heptaoxide dichloride hemihydrate
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: i16 - i18
• a: 6.1393 ± 0.0015 Å
• b: 6.386 ± 0.002 Å
• c: 12.005 ± 0.003 Å
• α: 81.75 ± 0.04°
• β: 85.76 ± 0.03°
• γ: 86.18 ± 0.03°
• Cell volume: 463.8 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 0.851
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No