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2-(5-Methyl-1,3,4-oxa-diazol-2-yl)phenyl acetate.

ABSTRACT: In the title compound, C11H10N2O3, which is a potential bioactive compound, the benzene and oxa-diazole rings are approximately coplanar, with an inter-ring dihedral angle of 4.14?(2)°, while the ester plane is rotated out of the benzene plane [dihedral angle = 82.69?(9)°]. In the crystal, the mol-ecules form layers down the a axis with weak ?-? inter-actions between the oxa-diazole and benzene rings [minimum ring centroid separation = 3.7706?(14)?Å].

SUBMITTER: Dos Santos AF

PROVIDER: S-EPMC4011247 | biostudies-literature | 2014 May

REPOSITORIES: biostudies-literature

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2-(5-Methyl-1,3,4-oxa-diazol-2-yl)phenyl acetate.

Dos Santos Alexsandro F AF Cristiano Rodrigo R Athayde-Filho Petrônio F PF Bortoluzzi Adailton J AJ

Acta crystallographica. Section E, Structure reports online 20140416 Pt 5

In the title compound, C11H10N2O3, which is a potential bioactive compound, the benzene and oxa-diazole rings are approximately coplanar, with an inter-ring dihedral angle of 4.14 (2)°, while the ester plane is rotated out of the benzene plane [dihedral angle = 82.69 (9)°]. In the crystal, the mol-ecules form layers down the a axis with weak π-π inter-actions between the oxa-diazole and benzene rings [minimum ring centroid separation = 3.7706 (14) Å]. ...[more]

PMID: 24860366

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