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Crystal structure of 1,4,5,6,7,8,9,10,11,12,13-undeca-hydro-cyclo-dodeca[c]pyrazol-3-ol.

ABSTRACT: The title compound, C13H22N2O, crystallized as a pyrazolol tautomer. The 12-membered macrocycle has a distorted chair conformation. In the crystal, mol-ecules are linked via pairs of O-H?N hydrogen bonds, forming inversion dimers. The dimers are linked via N-H?? and C-H?? inter-actions, forming slabs parallel to the bc plane.

SUBMITTER: Raymond CC

PROVIDER: S-EPMC4647396 | biostudies-literature | 2015 Oct

REPOSITORIES: biostudies-literature

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Crystal structure of 1,4,5,6,7,8,9,10,11,12,13-undeca-hydro-cyclo-dodeca[c]pyrazol-3-ol.

Raymond Casey C CC Knopp Michael A MA

Acta crystallographica. Section E, Crystallographic communications 20150912 Pt 10

The title compound, C13H22N2O, crystallized as a pyrazolol tautomer. The 12-membered macrocycle has a distorted chair conformation. In the crystal, mol-ecules are linked via pairs of O-H⋯N hydrogen bonds, forming inversion dimers. The dimers are linked via N-H⋯π and C-H⋯π inter-actions, forming slabs parallel to the bc plane. ...[more]

PMID: 26594458

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