Information card for entry 7252096

Structure parameters

• Formula: C10 H15 N5 O3
• Calculated formula: C10 H15 N5 O3
• Title of publication: Continuous Control of Thermal Responses in Dynamic Crystals via Solid Solution Engineering
• Authors of publication: Meng, Jiantao; Su, Yahui; Zhu, Hang; Chen, Wenrui; Chen, An; Su, Yuan; Cai, Ting
• Journal of publication: CrystEngComm
• Year of publication: 2026
• a: 11.7938 ± 0.0003 Å
• b: 10.9225 ± 0.0003 Å
• c: 8.9572 ± 0.0003 Å
• α: 90°
• β: 99.877 ± 0.002°
• γ: 90°
• Cell volume: 1136.74 ± 0.06 ų
• Cell temperature: 400 ± 2 K
• Ambient diffraction temperature: 400 K
• Number of distinct elements: 4
• 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: 0.0747
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.1897
• Weighted residual factors for all reflections included in the refinement: 0.2006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No