Information card for entry 7232452

Structure parameters

• Formula: C10 H12 N4 O
• Calculated formula: C10 H12 N4 O
• Title of publication: Revisiting Ag‒π interactions with bis((pyrrol-2-yl)methylene)hydrazine: CC versus CN bond complexation
• Authors of publication: Baudron, Stéphane A.; Chevreau, Hubert
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 12
• Pages of publication: 1853
• a: 11.9283 ± 0.0006 Å
• b: 6.5439 ± 0.0003 Å
• c: 6.8123 ± 0.0003 Å
• α: 90°
• β: 105.114 ± 0.002°
• γ: 90°
• Cell volume: 513.36 ± 0.04 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1223
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No