Title: Materials Data on SBr2O by Materials Project

Abstract

SOBr2 crystallizes in the orthorhombic Pca2_1 space group. The structure is zero-dimensional and consists of eight thionyl bromide molecules. S2- is bonded in a distorted single-bond geometry to one O2- and two Br2+ atoms. The S–O bond length is 1.46 Å. There are one shorter (2.28 Å) and one longer (2.31 Å) S–Br bond lengths. O2- is bonded in a single-bond geometry to one S2- atom. There are two inequivalent Br2+ sites. In the first Br2+ site, Br2+ is bonded in a single-bond geometry to one S2- atom. In the second Br2+ site, Br2+ is bonded in a single-bond geometry to one S2- atom.

Publication Date:
Other Number(s):
mp-28407
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Br-O-S; crystal structure; SBr2O
OSTI Identifier:
1202524
DOI:
https://doi.org/10.17188/1202524

Citation Formats

Materials Data on SBr2O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1202524.
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Materials Data on SBr2O by Materials Project. United States. doi:https://doi.org/10.17188/1202524
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2020. "Materials Data on SBr2O by Materials Project". United States. doi:https://doi.org/10.17188/1202524. https://www.osti.gov/servlets/purl/1202524. Pub date:Wed Apr 29 20:00:00 EDT 2020
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@article{osti_1202524,
title = {Materials Data on SBr2O by Materials Project},
abstractNote = {SOBr2 crystallizes in the orthorhombic Pca2_1 space group. The structure is zero-dimensional and consists of eight thionyl bromide molecules. S2- is bonded in a distorted single-bond geometry to one O2- and two Br2+ atoms. The S–O bond length is 1.46 Å. There are one shorter (2.28 Å) and one longer (2.31 Å) S–Br bond lengths. O2- is bonded in a single-bond geometry to one S2- atom. There are two inequivalent Br2+ sites. In the first Br2+ site, Br2+ is bonded in a single-bond geometry to one S2- atom. In the second Br2+ site, Br2+ is bonded in a single-bond geometry to one S2- atom.},
doi = {10.17188/1202524},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}
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DOI: https://doi.org/10.17188/1202524
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