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

Casey C. Raymond¹  Michael A. Knopp² 

[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...π interaction;   

DOI  :  10.1107/S2056989015016746

来源: DOAJ

【 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】

Unknown