Information card for entry 7064078

Structure parameters

• Formula: C28 H40 Au Cl3 N2 O
• Calculated formula: C28 H40 Au Cl3 N2 O
• Title of publication: Expanded ring 1,3,5-oxadiazinan-4-ylidene complexes: synthesis and catalysis
• Authors of publication: Isaeva, Dilshodakhon K.; Topchiy, Maxim A.; Drokin, Egor A.; Rasskazova, Mariya A.; Minaeva, Lidiya I.; Smol’yakov, Alexander F.; Asachenko, Andrey F.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 46
• Pages of publication: 20073 - 20080
• a: 8.2856 ± 0.0003 Å
• b: 15.7171 ± 0.0005 Å
• c: 23.3139 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3036.07 ± 0.19 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0258
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No