Information card for entry 7217576

Structure parameters

• Formula: C44 H36 Cl7 Hg3.5 Mo2 N16
• Calculated formula: C43.92 H35.92 Cl7.2 Hg3.6 Mo2 N16
• Title of publication: Stepwise formation of heteronuclear coordination networks based on quadruple-bonded dimolybdenum units containing formamidinate ligands
• Authors of publication: Hsu, Wayne; Li, Yu-Sian; He, Hsiu-Yi; Chen, Kuan-Ting; Wu, Hong-Sheng; Proserpio, Davide M.; Chen, Jhy-Der; Wang, Ju-Chun
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 32
• Pages of publication: 7385
• a: 12.8206 ± 0.0007 Å
• b: 12.7766 ± 0.0007 Å
• c: 17.2962 ± 0.0009 Å
• α: 90°
• β: 95.517 ± 0.002°
• γ: 90°
• Cell volume: 2820.1 ± 0.3 ų
• Cell temperature: 99 ± 2 K
• Ambient diffraction temperature: 99 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.1631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7215487
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No