CrFe3N is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Cr(1) is bonded to twelve equivalent Fe(1) atoms to form CrFe12 cuboctahedra that share corners with twelve equivalent Cr(1)Fe12 cuboctahedra, faces with six equivalent Cr(1)Fe12 cuboctahedra, and faces with eight equivalent N(1)Fe6 octahedra. Fe(1) is bonded in a linear geometry to four equivalent Cr(1) and two equivalent N(1) atoms. N(1) is bonded to six equivalent Fe(1) atoms to form NFe6 octahedra that share corners with six equivalent N(1)Fe6 octahedra and faces with eight equivalent Cr(1)Fe12 cuboctahedra. The corner-sharing octahedra are not tilted.
CrFe3N is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Cr(1) is bonded to twelve equivalent Fe(1) atoms to form CrFe12 cuboctahedra that share corners with twelve equivalent Cr(1)Fe12 cuboctahedra, faces with six equivalent Cr(1)Fe12 cuboctahedra, and faces with eight equivalent N(1)Fe6 octahedra. All Cr(1)-Fe(1) bond lengths are 2.69 Å. Fe(1) is bonded in a linear geometry to four equivalent Cr(1) and two equivalent N(1) atoms. Both Fe(1)-N(1) bond lengths are 1.90 Å. N(1) is bonded to six equivalent Fe(1) atoms to form NFe6 octahedra that share corners with six equivalent N(1)Fe6 octahedra and faces with eight equivalent Cr(1)Fe12 cuboctahedra. The corner-sharing octahedra are not tilted.