Title: Materials Data on H3CSClO by Materials Project

Abstract

CH3SOCl crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four methane molecules and four SOCl clusters. In each SOCl cluster, S2- is bonded in a 1-coordinate geometry to one O2- and one Cl1- atom. The S–O bond length is 1.48 Å. The S–Cl bond length is 2.17 Å. O2- is bonded in a single-bond geometry to one S2- atom. Cl1- is bonded in a single-bond geometry to one S2- atom.

Publication Date:
Other Number(s):
mp-644221
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; C-Cl-H-O-S; crystal structure; H3CSClO
OSTI Identifier:
1280405
DOI:
https://doi.org/10.17188/1280405

Citation Formats

Materials Data on H3CSClO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280405.
Copy to clipboard
Materials Data on H3CSClO by Materials Project. United States. doi:https://doi.org/10.17188/1280405
Copy to clipboard
2020. "Materials Data on H3CSClO by Materials Project". United States. doi:https://doi.org/10.17188/1280405. https://www.osti.gov/servlets/purl/1280405. Pub date:Wed Jul 22 20:00:00 EDT 2020
Copy to clipboard
@article{osti_1280405,
title = {Materials Data on H3CSClO by Materials Project},
abstractNote = {CH3SOCl crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four methane molecules and four SOCl clusters. In each SOCl cluster, S2- is bonded in a 1-coordinate geometry to one O2- and one Cl1- atom. The S–O bond length is 1.48 Å. The S–Cl bond length is 2.17 Å. O2- is bonded in a single-bond geometry to one S2- atom. Cl1- is bonded in a single-bond geometry to one S2- atom.},
doi = {10.17188/1280405},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Copy to clipboard
Dataset:
View Dataset
DOI: https://doi.org/10.17188/1280405
Save / Share:
Export Metadata
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.

Similar records in DOE Data Explorer and OSTI.GOV collections: