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3,5-Dimethyl-1-phenyl-1H-pyrazole-4-carbaldehyde.

ABSTRACT: In the title mol-ecule, C(12)H(12)N(2)O, the five- and six-membered rings form a dihedral angle of 68.41?(16)°. The aldehyde group is nearly coplanar with the pyrazole ring [C-C-C-O torsion angle = -0.4?(5)°]. The three-dimensional architecture is sustained by weak C-H?O and C-H?? inter-actions.

SUBMITTER: Al-Youbi AO

PROVIDER: S-EPMC3344012 | biostudies-literature | 2012 Apr

REPOSITORIES: biostudies-literature

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3,5-Dimethyl-1-phenyl-1H-pyrazole-4-carbaldehyde.

Al-Youbi Abdulrahman O AO Asiri Abdullah M AM Faidallah Hassan M HM Ng Seik Weng SW Tiekink Edward R T ER

Acta crystallographica. Section E, Structure reports online 20120314 Pt 4

In the title mol-ecule, C(12)H(12)N(2)O, the five- and six-membered rings form a dihedral angle of 68.41 (16)°. The aldehyde group is nearly coplanar with the pyrazole ring [C-C-C-O torsion angle = -0.4 (5)°]. The three-dimensional architecture is sustained by weak C-H⋯O and C-H⋯π inter-actions. ...[more]

PMID: 22589921

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