Crystal structure of 1,4,5,6,7,8,9,10,11,12,13-undeca­hydro­cyclo­dodeca[c]pyrazol-3-ol

Acta Crystallographica Section E: Crystallographic Communications

Raymond, C.C.¹  Knopp, M.A.² 

[1] Department of Chemistry, 296 Shineman Center, SUNY Oswego, Oswego, NY 13126, USA;Environmental Science and Sustainability Department, 307 South Hall, 181 Main St., University of Maine at Presque Isle, Presque Isle, Maine 04769, USA

关键词: CRYSTAL STRUCTURE;    PYRAZOLOL;    TAUTOMER;    PYRAZOLONE;    MACROCYCLE;    O-H...N HYDROGEN BOND;    N-H...[PI] INTERACTION;   

DOI  :  10.1107/S2056989015016746

学科分类：数学（综合）

来源: International Union of Crystallography

【 摘 要 】

The title compound, C13H22N2O, crystallized as a pyrazolol tautomer. The 12-membered macrocycle has a distorted chair conformation. In the crystal, mol­ecules 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 inter­actions, forming slabs parallel to the bc plane.

【 授权许可】

CC BY