Information card for entry 7232661

Structure parameters

• Formula: C34 H59 N7 O2
• Calculated formula: C34 H59 N7 O2
• Title of publication: Cold crystallization in the mixed system of adenine and thymine dodecyl derivatives
• Authors of publication: Kimijima, Ayaka; Honda, Akinori; Nomoto, Kuniharu; Miyamura, Kazuo
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 20
• Pages of publication: 3142
• a: 8.403 ± 0.0014 Å
• b: 10.9764 ± 0.0018 Å
• c: 20.319 ± 0.003 Å
• α: 99.433 ± 0.002°
• β: 94.128 ± 0.002°
• γ: 109.784 ± 0.002°
• Cell volume: 1723.2 ± 0.5 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1122
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1631
• Weighted residual factors for all reflections included in the refinement: 0.1955
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No