(E)-N-(4-{[1-(Prop-2-en-1-yl)-1H-1,2,3-triazol-4-yl]meth-oxy}benzyl-idene)morpholin-4-amine.

ABSTRACT: The asymmetric unit of the title compound, C17H21N5O2, contains two crystallographically independent mol-ecules, which are linked by a C-H?N hydrogen bond. The morpholine rings of both mol-ecules adopt distorted chair conformations. The dihedral angles between the triazole and benzene rings are 12.8?(3)° in the first independent molecule in which the -N=C- group between the morpholine and benzene rings is disordered [site-occupancy ratio = 0.576?(7):0.424?(7)] and 88.1?(2)° in the second independent mol-ecule. In the crystal, mol-ecules are linked by C-H?N hydrogen bonds along the [100] direction. In addition, one weak C-H?? inter-action and two weak ?-? stacking inter-actions [centroid-centroid distances = 3.840?(3) and 3.823?(2)?Å] between the triazole rings of adjacent mol-ecules are observed. The atoms of the terminal propenyl groups in both mol-ecules are disordered over two sets of sites [site-occupancy ratios = 0.691?(10):0.309?(10) and 0.705?(15):0.295?(15)].

SUBMITTER: Akkurt M 

PROVIDER: S-EPMC3998471 | biostudies-literature | 2014 Mar

REPOSITORIES: biostudies-literature