LiFeN crystallizes in the hexagonal P-6m2 space group. Li(1) is bonded in a linear geometry to two equivalent N(1) atoms. Fe(1) is bonded in a trigonal planar geometry to three equivalent N(1) atoms. N(1) is bonded to two equivalent Li(1) and three equivalent Fe(1) atoms to form corner-sharing NLi2Fe3 trigonal bipyramids.
LiFeN crystallizes in the hexagonal P-6m2 space group. Li(1) is bonded in a linear geometry to two equivalent N(1) atoms. Both Li(1)-N(1) bond lengths are 2.07 Å. Fe(1) is bonded in a trigonal planar geometry to three equivalent N(1) atoms. All Fe(1)-N(1) bond lengths are 1.79 Å. N(1) is bonded to two equivalent Li(1) and three equivalent Fe(1) atoms to form corner-sharing NLi2Fe3 trigonal bipyramids.