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Title: Materials Data on HgCN2 by Materials Project

Abstract

HgCN2 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two HgCN2 ribbons oriented in the (0, 1, 0) direction. Hg2+ is bonded in a 2-coordinate geometry to two equivalent N3- atoms. Both Hg–N bond lengths are 2.11 Å. C4+ is bonded in a linear geometry to two N3- atoms. There is one shorter (1.20 Å) and one longer (1.29 Å) C–N bond length. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a distorted trigonal planar geometry to two equivalent Hg2+ and one C4+ atom. In the second N3- site, N3- is bonded in a distorted single-bond geometry to one C4+ atom.

Publication Date:
Other Number(s):
mp-570848
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; HgCN2; C-Hg-N
OSTI Identifier:
1275939
DOI:
https://doi.org/10.17188/1275939

Citation Formats

The Materials Project. Materials Data on HgCN2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1275939.
The Materials Project. Materials Data on HgCN2 by Materials Project. United States. doi:https://doi.org/10.17188/1275939
The Materials Project. 2020. "Materials Data on HgCN2 by Materials Project". United States. doi:https://doi.org/10.17188/1275939. https://www.osti.gov/servlets/purl/1275939. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1275939,
title = {Materials Data on HgCN2 by Materials Project},
author = {The Materials Project},
abstractNote = {HgCN2 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two HgCN2 ribbons oriented in the (0, 1, 0) direction. Hg2+ is bonded in a 2-coordinate geometry to two equivalent N3- atoms. Both Hg–N bond lengths are 2.11 Å. C4+ is bonded in a linear geometry to two N3- atoms. There is one shorter (1.20 Å) and one longer (1.29 Å) C–N bond length. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a distorted trigonal planar geometry to two equivalent Hg2+ and one C4+ atom. In the second N3- site, N3- is bonded in a distorted single-bond geometry to one C4+ atom.},
doi = {10.17188/1275939},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}