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Title: Materials Data on S(IO3)2 by Materials Project

Abstract

S(O3I)2 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of two S(O3I)2 sheets oriented in the (0, 0, 1) direction. S2+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.49 Å) and two longer (1.51 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one S2+ and one I5+ atom. The O–I bond length is 2.46 Å. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one S2+ and one I5+ atom. The O–I bond length is 2.38 Å. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent I5+ atoms. There are one shorter (2.00 Å) and one longer (2.01 Å) O–I bond lengths. I5+ is bonded in a square co-planar geometry to four O2- atoms.

Publication Date:
Other Number(s):
mp-30984
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; S(IO3)2; I-O-S
OSTI Identifier:
1205320
DOI:
https://doi.org/10.17188/1205320

Citation Formats

The Materials Project. Materials Data on S(IO3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1205320.
The Materials Project. Materials Data on S(IO3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1205320
The Materials Project. 2020. "Materials Data on S(IO3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1205320. https://www.osti.gov/servlets/purl/1205320. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1205320,
title = {Materials Data on S(IO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {S(O3I)2 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of two S(O3I)2 sheets oriented in the (0, 0, 1) direction. S2+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.49 Å) and two longer (1.51 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one S2+ and one I5+ atom. The O–I bond length is 2.46 Å. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one S2+ and one I5+ atom. The O–I bond length is 2.38 Å. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent I5+ atoms. There are one shorter (2.00 Å) and one longer (2.01 Å) O–I bond lengths. I5+ is bonded in a square co-planar geometry to four O2- atoms.},
doi = {10.17188/1205320},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}