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Title: Materials Data on H3ClO5 by Materials Project

Abstract

H3OClO4 is Modderite-like structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four hydrogen hydrate molecules and four ClO4 clusters. In each ClO4 cluster, there are three 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 1.48 Å. In the third O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.44 Å. Cl is bonded in a tetrahedral geometry to four O atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-625159
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; H3ClO5; Cl-H-O
OSTI Identifier:
1278320
DOI:
10.17188/1278320

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on H3ClO5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1278320.
Persson, Kristin, & Project, Materials. Materials Data on H3ClO5 by Materials Project. United States. doi:10.17188/1278320.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on H3ClO5 by Materials Project". United States. doi:10.17188/1278320. https://www.osti.gov/servlets/purl/1278320. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1278320,
title = {Materials Data on H3ClO5 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {H3OClO4 is Modderite-like structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four hydrogen hydrate molecules and four ClO4 clusters. In each ClO4 cluster, there are three 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 1.48 Å. In the third O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.44 Å. Cl is bonded in a tetrahedral geometry to four O atoms.},
doi = {10.17188/1278320},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

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