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Crystal structure of 1,5-diethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-di-thione.

Lamkaddem A, Harcharras M, Shaim A, Zouihri H, Echchahed B, Bi W - Acta Crystallogr E Crystallogr Commun (2015)

Bottom Line: In the title compound, C13H16N2S2, the seven-membered ring adopts a boat conformation, with the two phenyl-ene C atoms representing the stern and the methyl-ene C atom as the prow.The thione S atoms and N-bound ethyl groups lie on the opposite side of the mol-ecule to the phenyl-ene ring so that the mol-ecule approximates mirror symmetry.In the crystal, supra-molecular layers in the bc plane are sustained by a pair of C-H⋯S inter-actions to the same S atom acceptor.

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Affiliation: Laboratoire de Synthèse Organique et des Procédés Éxtraction, Université Ibn Tofail, Faculté des Sciences, 14000 Kénitra, Morocco.

ABSTRACT
In the title compound, C13H16N2S2, the seven-membered ring adopts a boat conformation, with the two phenyl-ene C atoms representing the stern and the methyl-ene C atom as the prow. The thione S atoms and N-bound ethyl groups lie on the opposite side of the mol-ecule to the phenyl-ene ring so that the mol-ecule approximates mirror symmetry. In the crystal, supra-molecular layers in the bc plane are sustained by a pair of C-H⋯S inter-actions to the same S atom acceptor.

No MeSH data available.


The structure of the title compound, showing atom labelling and 30% probability displacement ellipsoids.
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Fap1: The structure of the title compound, showing atom labelling and 30% probability displacement ellipsoids.


Crystal structure of 1,5-diethyl-1H-1,5-benzodiazepine-2,4(3H,5H)-di-thione.

Lamkaddem A, Harcharras M, Shaim A, Zouihri H, Echchahed B, Bi W - Acta Crystallogr E Crystallogr Commun (2015)

The structure of the title compound, showing atom labelling and 30% probability displacement ellipsoids.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC4384617&req=5

Fap1: The structure of the title compound, showing atom labelling and 30% probability displacement ellipsoids.
Bottom Line: In the title compound, C13H16N2S2, the seven-membered ring adopts a boat conformation, with the two phenyl-ene C atoms representing the stern and the methyl-ene C atom as the prow.The thione S atoms and N-bound ethyl groups lie on the opposite side of the mol-ecule to the phenyl-ene ring so that the mol-ecule approximates mirror symmetry.In the crystal, supra-molecular layers in the bc plane are sustained by a pair of C-H⋯S inter-actions to the same S atom acceptor.

View Article: PubMed Central - HTML - PubMed

Affiliation: Laboratoire de Synthèse Organique et des Procédés Éxtraction, Université Ibn Tofail, Faculté des Sciences, 14000 Kénitra, Morocco.

ABSTRACT
In the title compound, C13H16N2S2, the seven-membered ring adopts a boat conformation, with the two phenyl-ene C atoms representing the stern and the methyl-ene C atom as the prow. The thione S atoms and N-bound ethyl groups lie on the opposite side of the mol-ecule to the phenyl-ene ring so that the mol-ecule approximates mirror symmetry. In the crystal, supra-molecular layers in the bc plane are sustained by a pair of C-H⋯S inter-actions to the same S atom acceptor.

No MeSH data available.