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Crystal structure of 3-amino-5,5-dimethyl-2-[(E)-2-nitro-ethen-yl]cyclo-hex-2-en-1-one.

ABSTRACT: The asymmetric unit of the title compound, C10H14N2O3, contains two independent mol-ecules with similar conformations. In the both mol-ecules, the cyclo-hexene rings adopt the same envelope conformation with the flap C atoms lying 0.658?(3) and 0.668?(3)?Å from the mean planes formed by the remaining atoms. In the crystal, adjacent mol-ecules are connected via N-H?O hydrogen bonds and weak C-H?O inter-actions, forming supra-molecular layers parallel to (-101).

SUBMITTER: Vigante B

PROVIDER: S-EPMC4257328 | biostudies-literature | 2014 Nov

REPOSITORIES: biostudies-literature

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Crystal structure of 3-amino-5,5-dimethyl-2-[(E)-2-nitro-ethen-yl]cyclo-hex-2-en-1-one.

Vigante Brigita B Stepanovs Dmitrijs D Pelss Andrejs A Mishnev Anatoly A

Acta crystallographica. Section E, Structure reports online 20141024 Pt 11

The asymmetric unit of the title compound, C10H14N2O3, contains two independent mol-ecules with similar conformations. In the both mol-ecules, the cyclo-hexene rings adopt the same envelope conformation with the flap C atoms lying 0.658 (3) and 0.668 (3) Å from the mean planes formed by the remaining atoms. In the crystal, adjacent mol-ecules are connected via N-H⋯O hydrogen bonds and weak C-H⋯O inter-actions, forming supra-molecular layers parallel to (-101). ...[more]

PMID: 25484751

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