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3-[2-(4,4-Dimethyl-2,6-dioxocyclo-hexyl-idene)hydrazin-yl]benzonitrile.

ABSTRACT: The title compound, C(15)H(15)N(3)O(2), contains benzonitrile and 4,4-dimethyl-2,6-dioxocyclo-hexyl-idene groups connected via a hydrazinyl group. The structure is in the hydrazone tautomeric form in the solid state. The benzonitrile and hydrazinyl groups (3-hydrazinylbenzonitrile) are essentially coplanar with an r.m.s. deviation of 0.016?Å. Intra-molecular N-H?O hydrogen bonding helps to stabilize the mol-ecular structure, and weak inter-molecular C-H?O hydrogen bonding is present in the crystal structure.

SUBMITTER: Colak N

PROVIDER: S-EPMC2979068 | biostudies-literature | 2010 Apr

REPOSITORIES: biostudies-literature

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3-[2-(4,4-Dimethyl-2,6-dioxocyclo-hexyl-idene)hydrazin-yl]benzonitrile.

Colak Naki N Aksakal Didem D Andaç Omer O Büyükgüngör Orhan O

Acta crystallographica. Section E, Structure reports online 20100424 Pt 5

The title compound, C(15)H(15)N(3)O(2), contains benzonitrile and 4,4-dimethyl-2,6-dioxocyclo-hexyl-idene groups connected via a hydrazinyl group. The structure is in the hydrazone tautomeric form in the solid state. The benzonitrile and hydrazinyl groups (3-hydrazinylbenzonitrile) are essentially coplanar with an r.m.s. deviation of 0.016 Å. Intra-molecular N-H⋯O hydrogen bonding helps to stabilize the mol-ecular structure, and weak inter-molecular C-H⋯O hydrogen bonding is present in the cryst ...[more]

PMID: 21579208

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