3-(2,5-Dimethyl-furan-3-yl)-1H-pyrazol-5-ol-ethyl 3-(propan-2-yl-idene)carbazate (1/1).

Tara Shahani, Hoong-Kun Fun, R Venkat Ragavan, V Vijayakumar, S Sarveswari
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Abstract

In the title 1:1 adduct, C(6)H(12)N(2)O(2)·C(9)H(10)N(2)O(2), the maximum deviations from the 1H-pyrazole-5-ol and furan rings are 0.014 (1) and 0.003 (1) Å, respectively. The dihedral angle formed between the 1H-pyrazol-5-ol and 2,5-dimethyl-furan rings is 21.07 (5)°. In the crystal, pairs of inter-molecular O-H⋯N hydrogen bonds form inversion dimers of the 3-(2,5-dimethyl-furan-3-yl)-1H-pyrazol-5-ol species, generating R(2) (2)(8) ring motifs. Mol-ecules are further linked by inter-molecular N-H⋯O, N-H⋯N and C-H⋯O hydrogen bonds to form ribbons along the [010] direction containing bifurcated R(1) (2)(5) and R(2) (1)(7) ring motifs. Further stablization of the packing is provided by weak π-π [centroid-centroid distance = 3.5686 (15) Å] and C-H⋯π inter-actions.

References

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Word Cloud

Created with Highcharts 10.0.0213-RHNOrings05inter-molecularhydrogenbondsformringmotifstitle1:1adductC612·C910maximumdeviations1H-pyrazole-5-olfuran014 003  Årespectivelydihedralangleformed1H-pyrazol-5-ol5-dimethyl-furan2107 °crystalpairsO-H⋯Ninversiondimers5-dimethyl-furan-3-yl-1H-pyrazol-5-olspeciesgenerating8Mol-eculeslinkedN-H⋯ON-H⋯NC-H⋯Oribbonsalong[010]directioncontainingbifurcated7stablizationpackingprovidedweakπ-π[centroid-centroiddistance=35686 15 Å]C-H⋯πinter-actions5-Dimethyl-furan-3-yl-1H-pyrazol-5-ol-ethylpropan-2-yl-idenecarbazate1/1

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