The asymmetric unit of the title mol-ecule, C(8)H(7)NO(3), consists of two mol-ecules differing slightly in conformation and in their inter-molecular inter-actions in the solid. The dihedral angle between the benzene and dioxolane rings is 0.20â (7)° in one mol-ecule and 0.31â (7)° in the other. In the crystal, the two mol-ecules are linked into dimers through pairwise O-Hâ¯N hydrogen bonds, with these units being formed into stacks by two different sets of aromatic Ï-stacking inter-actions. The stacks are connected by C-Hâ¯O hydrogen bonds. A Hirshfeld surface analysis indicates that the most significant contacts in the crystal packing are Hâ¯O/Oâ¯H (36.7%), Hâ¯H (32.2%) and Câ¯H/Hâ¯C (12.7%).
Synthesis, crystal structure and Hirshfeld surface analysis of (E)-benzo[d][1,3]dioxole-5-carbaldehyde oxime.
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作者:Radhakrishnan Rengaraj, Mustaphi Nour El Hoda, Sebbar Nada Kheira, Mague Joel T, Thiruvalluvar Aravazhi Amalan
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2023 | 起止号: | 2023 May 16; 79(Pt 6):545-548 |
| doi: | 10.1107/S2056989023004139 | ||
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