Materials Data on CrCuN6Cl5 by Materials Project
Cr(N2Cl)3CuCl2 crystallizes in the cubic Pn-3m space group. The structure is three-dimensional and consists of four copper chloride molecules and one Cr(N2Cl)3 framework. In the Cr(N2Cl)3 framework, Cr6+ is bonded in a hexagonal planar geometry to six equivalent N+0.33- atoms. All Cr–N bond lengths are 1.83 Å. N+0.33- is bonded in a distorted single-bond geometry to one Cr6+ and two equivalent Cl1- atoms. Both N–Cl bond lengths are 2.27 Å. Cl1- is bonded in a distorted rectangular see-saw-like geometry to four equivalent N+0.33- atoms.
- 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:
- 1318242
- Report Number(s):
- mp-1006615
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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