Information card for entry 7720058

Structure parameters

• Formula: C24 H24 N2 O4 W
• Calculated formula: C24 H24 N2 O4 W
• Title of publication: Electronically and sterically varied tungsten carbonyls applied to the selective dearomatization of N-heteroarenes.
• Authors of publication: Bai, Pengtao; Liu, Yuzan; Fang, Li; Li, Ying; Wang, Jiahao; Cai, Yougen; Chen, Lei; Zhao, Jia-Jia; Song, Heng; Zong, Luyi; Xu, Chen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 3454 - 3459
• a: 12.344 ± 0.004 Å
• b: 9.316 ± 0.004 Å
• c: 21.158 ± 0.009 Å
• α: 90°
• β: 104.3 ± 0.02°
• γ: 90°
• Cell volume: 2357.7 ± 1.6 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0981
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.0775
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No