Information card for entry 7711713

Structure parameters

• Formula: C44 H44 Mo4 N12 O18 S6
• Calculated formula: C44 H44 Mo4 N12 O18 S6
• Title of publication: Binuclear, tetranuclear and hexadecanuclear thio-oxomolybdenum(V/IV) glycolates with selective adsorptions of gases.
• Authors of publication: Lin, Rong-Yan; Deng, Lan; An, Dong-Li; Zhou, Zhao-Hui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 562 - 571
• a: 11.1684 ± 0.0002 Å
• b: 11.2139 ± 0.0002 Å
• c: 11.8751 ± 0.0002 Å
• α: 104.928 ± 0.001°
• β: 103.841 ± 0.001°
• γ: 98.245 ± 0.001°
• Cell volume: 1361.6 ± 0.04 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 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 all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No