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Title: Materials Data on SCl2O by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1202523· OSTI ID:1202523

SOCl2 is Ammonia-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four thionyl chloride molecules. S4+ is bonded in a trigonal non-coplanar geometry to one O2- and two equivalent Cl1- atoms. The S–O bond length is 1.45 Å. There are one shorter (2.10 Å) and one longer (2.11 Å) S–Cl bond lengths. O2- is bonded in a single-bond geometry to one S4+ atom. Cl1- is bonded in a single-bond geometry to one S4+ atom.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1202523
Report Number(s):
mp-28406
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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