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3-Meth-oxy-4-methyl-1H-1,2,4-triazol-5(4H)-one monohydrate.

Gao W, Wang XL, Yang J, Wu XF - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: In the title hydrate, C(4)H(7)N(3)O(2)·H(2)O, all the non-H atoms lie on a crystallographic mirror plane.The H atoms of both methyl groups are disordered over two sets of sites.In the crystal, N-H⋯O(w) and O(w)-H⋯O(k) (w = water and k = ketone) hydrogen bonds link the components into (010) sheets.

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Affiliation: School of Pharmacy, Henan University of Traditional Chinese Medicine, Zhengzhou 450008, People's Republic of China.

ABSTRACT
In the title hydrate, C(4)H(7)N(3)O(2)·H(2)O, all the non-H atoms lie on a crystallographic mirror plane. The H atoms of both methyl groups are disordered over two sets of sites. In the crystal, N-H⋯O(w) and O(w)-H⋯O(k) (w = water and k = ketone) hydrogen bonds link the components into (010) sheets.

No MeSH data available.


The crystal packing for (I).
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Fap2: The crystal packing for (I).


3-Meth-oxy-4-methyl-1H-1,2,4-triazol-5(4H)-one monohydrate.

Gao W, Wang XL, Yang J, Wu XF - Acta Crystallogr Sect E Struct Rep Online (2012)

The crystal packing for (I).
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3379480&req=5

Fap2: The crystal packing for (I).
Bottom Line: In the title hydrate, C(4)H(7)N(3)O(2)·H(2)O, all the non-H atoms lie on a crystallographic mirror plane.The H atoms of both methyl groups are disordered over two sets of sites.In the crystal, N-H⋯O(w) and O(w)-H⋯O(k) (w = water and k = ketone) hydrogen bonds link the components into (010) sheets.

View Article: PubMed Central - HTML - PubMed

Affiliation: School of Pharmacy, Henan University of Traditional Chinese Medicine, Zhengzhou 450008, People's Republic of China.

ABSTRACT
In the title hydrate, C(4)H(7)N(3)O(2)·H(2)O, all the non-H atoms lie on a crystallographic mirror plane. The H atoms of both methyl groups are disordered over two sets of sites. In the crystal, N-H⋯O(w) and O(w)-H⋯O(k) (w = water and k = ketone) hydrogen bonds link the components into (010) sheets.

No MeSH data available.