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1-(4,6-Dimethyl-pyrimidin-2-yl)-3-(3,5-dinitro-benzo-yl)thio-urea monohydrate.

ABSTRACT: The organic molecule in the title mol-ecule, C(14)H(12)N(6)O(5)S·H(2)O, is roughly planar with a maximum deviation of 0.156?(2)?Å. An intra-molecular N-H?N hydrogen bond occurs. In the crystal, inter-molecular N-H?O and O-H?O hydrogen-bonding inter-actions connect the mol-ecules into a two-dimensional network that lies parallel to (101).

SUBMITTER: Saeed S

PROVIDER: S-EPMC3089191 | biostudies-literature | 2011 May

REPOSITORIES: biostudies-literature

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1-(4,6-Dimethyl-pyrimidin-2-yl)-3-(3,5-dinitro-benzo-yl)thio-urea monohydrate.

Saeed Sohail S Rashid Naghmana N Wong Wing-Tak WT Hussain Rizwan R

Acta crystallographica. Section E, Structure reports online 20110413 Pt 5

The organic molecule in the title mol-ecule, C(14)H(12)N(6)O(5)S·H(2)O, is roughly planar with a maximum deviation of 0.156 (2) Å. An intra-molecular N-H⋯N hydrogen bond occurs. In the crystal, inter-molecular N-H⋯O and O-H⋯O hydrogen-bonding inter-actions connect the mol-ecules into a two-dimensional network that lies parallel to (101). ...[more]

PMID: 21754414

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