Information card for entry 7239789

Structure parameters

• Formula: C16 H27 F3 N8 O6
• Calculated formula: C16 H27 F3 N8 O6
• Title of publication: Efficient syntheses of macrocycles ranging from 22‒28 atoms through spontaneous dimerization to yield bis-hydrazones
• Authors of publication: Sharma, Vishal R.; Mehmood, Arshad; Janesko, Benjamin G.; Simanek, Eric E.
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 6
• Pages of publication: 3217 - 3220
• a: 24.515 ± 0.01 Å
• b: 8.492 ± 0.004 Å
• c: 25.298 ± 0.01 Å
• α: 90°
• β: 119.248 ± 0.012°
• γ: 90°
• Cell volume: 4595 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.13 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1309
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No