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6-Methyl-pyridine-2(1H)-thione.

ABSTRACT: There are two unique mol-ecules in the asymmetric unit of the title pyridine-thione derivative, C(6)H(7)NS, each of which adopts the thione rather than the mercaptan form. The rings in both mol-ecules are essentially planar, with maximum deviations from the least-squares planes through all non-H atoms of 0.021?(2) and 0.017?(2)?Å. In the crystal structure, the mol-ecules form centrosymmetric cyclic dimers through inter-molecular N-H?S hydrogen bonds. Additional C-H(meth-yl)?S inter-actions generate a three-dimensional network.

SUBMITTER: Lian GJ 

PROVIDER: S-EPMC2979122 | biostudies-literature | 2010 Apr

REPOSITORIES: biostudies-literature

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6-Methyl-pyridine-2(1H)-thione.

Lian Guo-Jun GJ   Chen Bo B   Zhang Ting-Ting TT   Zhuang Li-Zhen LZ   Liang Hong-Ze HZ  

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

There are two unique mol-ecules in the asymmetric unit of the title pyridine-thione derivative, C(6)H(7)NS, each of which adopts the thione rather than the mercaptan form. The rings in both mol-ecules are essentially planar, with maximum deviations from the least-squares planes through all non-H atoms of 0.021 (2) and 0.017 (2) Å. In the crystal structure, the mol-ecules form centrosymmetric cyclic dimers through inter-molecular N-H⋯S hydrogen bonds. Additional C-H(meth-yl)⋯S inter-actions gener  ...[more]

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