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Title: Materials Data on CoI7N6 by Materials Project

Abstract

Co(IN1)2(IN2)2(I)3 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two cobalt molecules; four jodamin molecules; four IN2 clusters; and two I ribbons oriented in the (0, 1, 0) direction. In each IN2 cluster, N+0.67+ is bonded in a distorted single-bond geometry to one I1- atom. The N–I bond length is 2.02 Å. I1- is bonded in a distorted L-shaped geometry to two equivalent N+0.67+ atoms. In each I ribbon, there are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a 8-coordinate geometry to four equivalent I1- atoms. All I–I bond lengths are 3.25 Å. In the second I1- site, I1- is bonded in a 2-coordinate geometry to two equivalent I1- atoms.

Authors:
Publication Date:
Other Number(s):
mp-1105312
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; CoI7N6; Co-I-N
OSTI Identifier:
1708308
DOI:
https://doi.org/10.17188/1708308

Citation Formats

The Materials Project. Materials Data on CoI7N6 by Materials Project. United States: N. p., 2018. Web. doi:10.17188/1708308.
The Materials Project. Materials Data on CoI7N6 by Materials Project. United States. doi:https://doi.org/10.17188/1708308
The Materials Project. 2018. "Materials Data on CoI7N6 by Materials Project". United States. doi:https://doi.org/10.17188/1708308. https://www.osti.gov/servlets/purl/1708308. Pub date:Thu Jul 19 00:00:00 EDT 2018
@article{osti_1708308,
title = {Materials Data on CoI7N6 by Materials Project},
author = {The Materials Project},
abstractNote = {Co(IN1)2(IN2)2(I)3 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two cobalt molecules; four jodamin molecules; four IN2 clusters; and two I ribbons oriented in the (0, 1, 0) direction. In each IN2 cluster, N+0.67+ is bonded in a distorted single-bond geometry to one I1- atom. The N–I bond length is 2.02 Å. I1- is bonded in a distorted L-shaped geometry to two equivalent N+0.67+ atoms. In each I ribbon, there are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a 8-coordinate geometry to four equivalent I1- atoms. All I–I bond lengths are 3.25 Å. In the second I1- site, I1- is bonded in a 2-coordinate geometry to two equivalent I1- atoms.},
doi = {10.17188/1708308},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2018},
month = {7}
}