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Title: Materials Data on MgC2S2(OF3)2 by Materials Project

Abstract

Mg(SO)2(CF3)2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four fluoroform molecules and two Mg(SO)2 clusters. In each Mg(SO)2 cluster, Mg2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Mg–O bond lengths are 1.91 Å. S is bonded in a distorted single-bond geometry to one O2- atom. The S–O bond length is 1.56 Å. O2- is bonded in a bent 150 degrees geometry to one Mg2+ and one S atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-684804
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; MgC2S2(OF3)2; C-F-Mg-O-S
OSTI Identifier:
1284006
DOI:
10.17188/1284006

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on MgC2S2(OF3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1284006.
Persson, Kristin, & Project, Materials. Materials Data on MgC2S2(OF3)2 by Materials Project. United States. doi:10.17188/1284006.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on MgC2S2(OF3)2 by Materials Project". United States. doi:10.17188/1284006. https://www.osti.gov/servlets/purl/1284006. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1284006,
title = {Materials Data on MgC2S2(OF3)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Mg(SO)2(CF3)2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four fluoroform molecules and two Mg(SO)2 clusters. In each Mg(SO)2 cluster, Mg2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Mg–O bond lengths are 1.91 Å. S is bonded in a distorted single-bond geometry to one O2- atom. The S–O bond length is 1.56 Å. O2- is bonded in a bent 150 degrees geometry to one Mg2+ and one S atom.},
doi = {10.17188/1284006},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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