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Crystal structure, Hirshfeld surface analysis, interaction energy and DFT studies of 4-[(4-allyl-2-methoxyphenoxy)methyl]-1-(4-methoxyphenyl)-1H-1,2,3-triazole
In the title molecule, C(20)H(21)N(3)O(3), the allyl substituent is rotated out of the plane of its attached phenyl ring [torsion angle 100.66 (15)°]. In the crystal, C—H(Mthphn)⋯O(Mthphn) (Mthphn = methoxyphenyl) hydrogen bonds lead to the formation of (100) layers that are connected into a thr...
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| Publicat a: | Acta Crystallogr E Crystallogr Commun |
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| Autors principals: | , , , , , , |
| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
International Union of Crystallography
2020
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| Matèries: | |
| Accés en línia: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7273996/ https://ncbi.nlm.nih.gov/pubmed/32523773 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S2056989020006994 |
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