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1,2-Bis[1-(3-methyl-sulfanyl-1,2,4-triazin-5-yl)ethyl-idene]diazane.

ABSTRACT: The mol-ecule of the title compound, C(12)H(14)N(8)S(2), has an N-N gauche conformation. The triazine rings are nearly coplanar with respect to the imide bonds [C-C-C-N torsion angles = -15.3?(3) and -15.8?(3)°] and they are twisted by 77.88?(7)°. The overall conformation of the mol-ecule is stabilized by intra-molecular C-H?N hydrogen bonding. The mol-ecular packing is influenced by ?-? inter-actions of the triazine systems with a shortest centroid-centroid separation of 3.5242?(12)?Å.

SUBMITTER: Mojzych M

PROVIDER: S-EPMC2977495 | biostudies-literature | 2009 Jul

REPOSITORIES: biostudies-literature

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1,2-Bis[1-(3-methyl-sulfanyl-1,2,4-triazin-5-yl)ethyl-idene]diazane.

Mojzych Mariusz M Karczmarzyk Zbigniew Z Urbańczyk-Lipkowska Zofia Z Kalicki Przemysław P

Acta crystallographica. Section E, Structure reports online 20090704 Pt 8

The mol-ecule of the title compound, C(12)H(14)N(8)S(2), has an N-N gauche conformation. The triazine rings are nearly coplanar with respect to the imide bonds [C-C-C-N torsion angles = -15.3 (3) and -15.8 (3)°] and they are twisted by 77.88 (7)°. The overall conformation of the mol-ecule is stabilized by intra-molecular C-H⋯N hydrogen bonding. The mol-ecular packing is influenced by π-π inter-actions of the triazine systems with a shortest centroid-centroid separation of 3.5242 (12) Å. ...[more]

PMID: 21583480

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