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Title: Materials Data on Zn3Rh2(CN)12 by Materials Project

Abstract

(Rh)2Zn(Zn(CN)6)2 crystallizes in the tetragonal P-4m2 space group. The structure is zero-dimensional and consists of two rhodium molecules, two Zn(CN)6 clusters, and one zinc molecule. In each Zn(CN)6 cluster, Zn2+ is bonded in an octahedral geometry to six N3- atoms. There are a spread of Zn–N bond distances ranging from 2.11–2.17 Å. There are three inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. In the second C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. In the third C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. There are three inequivalent N3- sites. In the first N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the second N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the third N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom.

Publication Date:
Other Number(s):
mp-1216037
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Zn3Rh2(CN)12; C-N-Rh-Zn
OSTI Identifier:
1757856
DOI:
https://doi.org/10.17188/1757856

Citation Formats

The Materials Project. Materials Data on Zn3Rh2(CN)12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1757856.
The Materials Project. Materials Data on Zn3Rh2(CN)12 by Materials Project. United States. doi:https://doi.org/10.17188/1757856
The Materials Project. 2020. "Materials Data on Zn3Rh2(CN)12 by Materials Project". United States. doi:https://doi.org/10.17188/1757856. https://www.osti.gov/servlets/purl/1757856. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1757856,
title = {Materials Data on Zn3Rh2(CN)12 by Materials Project},
author = {The Materials Project},
abstractNote = {(Rh)2Zn(Zn(CN)6)2 crystallizes in the tetragonal P-4m2 space group. The structure is zero-dimensional and consists of two rhodium molecules, two Zn(CN)6 clusters, and one zinc molecule. In each Zn(CN)6 cluster, Zn2+ is bonded in an octahedral geometry to six N3- atoms. There are a spread of Zn–N bond distances ranging from 2.11–2.17 Å. There are three inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. In the second C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. In the third C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. There are three inequivalent N3- sites. In the first N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the second N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the third N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom.},
doi = {10.17188/1757856},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}