Materials Data on KNiAu3(CN)6 by Materials Project

Dataset · Tue Jul 14 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1274086· OSTI ID:1274086

The Materials Project

KNiAu3(CN)6 crystallizes in the trigonal P312 space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to six equivalent N3- atoms. All K–N bond lengths are 3.01 Å. Ni2+ is bonded in an octahedral geometry to six equivalent N3- atoms. All Ni–N bond lengths are 2.06 Å. Au+0.33- is bonded in a linear geometry to two equivalent C+2.67+ atoms. Both Au–C bond lengths are 1.99 Å. C+2.67+ is bonded in a distorted single-bond geometry to one Au+0.33- and one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded in a 2-coordinate geometry to one K1+, one Ni2+, and one C+2.67+ atom.

• Research Organization: Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES)
• Contributing Organization: MIT; UC Berkeley; Duke; U Louvain
• DOE Contract Number: AC02-05CH11231; EDCBEE
• OSTI ID: 1274086
• Report Number(s): mp-567861
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
KNiAu3(CN)6
Au-C-K-N-Ni