Information card for entry 7700792

Structure parameters

• Formula: C21 H26 Mo2 N12 O6
• Calculated formula: C21 H26 Mo2 N12 O6
• Title of publication: [3 + 2] cycloaddition of azido-bridged molybdenum(ii) complex with nitriles and alkynes.
• Authors of publication: Chen, You-Xuan; Yang, Hsueh-Hui; Lin, Yu-Liang; Hou, Ji-Kuan; Chu, Yong-Jui; Liu, Fu-Chen; Lee, Gene-Hsiang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 34
• Pages of publication: 12996 - 13005
• a: 18.9939 ± 0.0004 Å
• b: 10.7176 ± 0.0002 Å
• c: 28.903 ± 0.0005 Å
• α: 90°
• β: 92.2762 ± 0.0008°
• γ: 90°
• Cell volume: 5879.11 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0563
• Residual factor for significantly intense reflections: 0.0325
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0722
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No