Information card for entry 7230550

Structure parameters

• Formula: C18 H14 N2 O4
• Calculated formula: C18 H14 N2 O4
• Title of publication: One-pot sequential multicomponent reaction between in situ generated aldimines and succinaldehyde: facile synthesis of substituted pyrrole-3-carbaldehydes and applications towards medicinally important fused heterocycles
• Authors of publication: Singh, Anoop; Mir, Nisar A.; Choudhary, Sachin; Singh, Deepika; Sharma, Preetika; Kant, Rajni; Kumar, Indresh
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 28
• Pages of publication: 15448
• a: 8.023 ± 0.0006 Å
• b: 10.5211 ± 0.0008 Å
• c: 18.4479 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1557.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No