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Title: Materials Data on HgH12(ClO7)2 by Materials Project

Abstract

Hg(H2O)6(ClO4)2 crystallizes in the trigonal P-3m1 space group. The structure is zero-dimensional and consists of two ClO4 clusters and one Hg(H2O)6 cluster. In each ClO4 cluster, there are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.47 Å. In the second O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.45 Å. Cl is bonded in a tetrahedral geometry to four O atoms. In the Hg(H2O)6 cluster, Hg is bonded in an octahedral geometry to six equivalent O atoms. All Hg–O bond lengths are 2.40 Å. H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. O is bonded in a distorted water-like geometry to one Hg and two equivalent H atoms.

Publication Date:
Other Number(s):
mp-634466
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; HgH12(ClO7)2; Cl-H-Hg-O
OSTI Identifier:
1279467
DOI:
10.17188/1279467

Citation Formats

The Materials Project. Materials Data on HgH12(ClO7)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279467.
The Materials Project. Materials Data on HgH12(ClO7)2 by Materials Project. United States. doi:10.17188/1279467.
The Materials Project. 2020. "Materials Data on HgH12(ClO7)2 by Materials Project". United States. doi:10.17188/1279467. https://www.osti.gov/servlets/purl/1279467. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1279467,
title = {Materials Data on HgH12(ClO7)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Hg(H2O)6(ClO4)2 crystallizes in the trigonal P-3m1 space group. The structure is zero-dimensional and consists of two ClO4 clusters and one Hg(H2O)6 cluster. In each ClO4 cluster, there are two inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.47 Å. In the second O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.45 Å. Cl is bonded in a tetrahedral geometry to four O atoms. In the Hg(H2O)6 cluster, Hg is bonded in an octahedral geometry to six equivalent O atoms. All Hg–O bond lengths are 2.40 Å. H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. O is bonded in a distorted water-like geometry to one Hg and two equivalent H atoms.},
doi = {10.17188/1279467},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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