The asymmetric unit of the title compound, 2C2H6N5(+)·C4O4(2-), contains two 3,5-diamino-4H-1,2,4-triazolium cations and one squarate dianion. The squaric acid mol-ecule donated one H atom to each of the two 3,5-diamino-1,2,4-triazole mol-ecules at their N atoms. The squaric acid dianion has four C-O bonds which are shorter than a normal single C-O bond (1.426â à ) and are slightly longer than a normal C=O bond (1.23â à ), which indicates the degree of electron delocalization in the dianion. In the crystal, the cations and dianions are linked by N-Hâ¯N and N-Hâ¯O hydrogen bonds into a three-dimensional network.
Bis-(3,5-diamino-4H-1,2,4-triazol-1-ium) 3,4-dioxocyclo-butane-1,2-diolate.
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作者:Fun Hoong-Kun, Loh Wan-Sin, Johnson Atim, Yousuf Sammer, Eno Ededet
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2013 | 起止号: | 2013 Mar 1; 69(Pt 3):o353-4 |
| doi: | 10.1107/S160053681300322X | ||
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