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Title: Materials Data on HgN2Cl4O by Materials Project

Abstract

HgNCl2NClClO crystallizes in the orthorhombic Pbam space group. The structure is zero-dimensional and consists of four chloramine molecules, two ClO clusters, and two HgNCl2 clusters. In each ClO cluster, O2- is bonded in a water-like geometry to two equivalent Cl1- atoms. Both O–Cl bond lengths are 1.81 Å. Cl1- is bonded in an L-shaped geometry to two equivalent O2- atoms. In each HgNCl2 cluster, Hg2+ is bonded in a distorted bent 150 degrees geometry to two equivalent Cl1- atoms. Both Hg–Cl bond lengths are 3.59 Å. N2+ is bonded in a water-like geometry to two equivalent Cl1- atoms. Both N–Cl bond lengths are 1.70 Å. Cl1- is bonded in a single-bond geometry to one Hg2+ and one N2+ atom.

Publication Date:
Other Number(s):
mp-1202562
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; HgN2Cl4O; Cl-Hg-N-O
OSTI Identifier:
1664081
DOI:
https://doi.org/10.17188/1664081

Citation Formats

The Materials Project. Materials Data on HgN2Cl4O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1664081.
The Materials Project. Materials Data on HgN2Cl4O by Materials Project. United States. doi:https://doi.org/10.17188/1664081
The Materials Project. 2020. "Materials Data on HgN2Cl4O by Materials Project". United States. doi:https://doi.org/10.17188/1664081. https://www.osti.gov/servlets/purl/1664081. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1664081,
title = {Materials Data on HgN2Cl4O by Materials Project},
author = {The Materials Project},
abstractNote = {HgNCl2NClClO crystallizes in the orthorhombic Pbam space group. The structure is zero-dimensional and consists of four chloramine molecules, two ClO clusters, and two HgNCl2 clusters. In each ClO cluster, O2- is bonded in a water-like geometry to two equivalent Cl1- atoms. Both O–Cl bond lengths are 1.81 Å. Cl1- is bonded in an L-shaped geometry to two equivalent O2- atoms. In each HgNCl2 cluster, Hg2+ is bonded in a distorted bent 150 degrees geometry to two equivalent Cl1- atoms. Both Hg–Cl bond lengths are 3.59 Å. N2+ is bonded in a water-like geometry to two equivalent Cl1- atoms. Both N–Cl bond lengths are 1.70 Å. Cl1- is bonded in a single-bond geometry to one Hg2+ and one N2+ atom.},
doi = {10.17188/1664081},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}