Information card for entry 7022068

Structure parameters

• Formula: C3 H31 Cr Mo6 N3 O29
• Calculated formula: C3 H31 Cr Mo6 N3 O29
• Title of publication: Transition metal-induced self-assembly of small molybdenum clusters.
• Authors of publication: Zhang, Weisong; Gong, Jingjing; Zhang, Lili; Yang, Yanan; Liu, Yang; Zhang, Hengchao; Zhang, Guangju; Dong, Huan; Hu, Hailiang; Zhao, Fangfang; Kang, Zhenhui
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 5
• Pages of publication: 1760 - 1769
• a: 21.8438 ± 0.001 Å
• b: 11.7484 ± 0.0006 Å
• c: 22.3792 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5743.2 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0257
• Residual factor for significantly intense reflections: 0.0202
• Weighted residual factors for significantly intense reflections: 0.0448
• Weighted residual factors for all reflections included in the refinement: 0.0465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No