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Materials Data on SnC2(SN)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1705344· OSTI ID:1705344
SnSC2SN2 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two nitrogen molecules, two C2S clusters, and two SnS clusters. In each C2S cluster, there are two inequivalent C4+ sites. In the first C4+ site, C4+ is bonded in a single-bond geometry to one S2- atom. The C–S bond length is 1.66 Å. In the second C4+ site, C4+ is bonded in a single-bond geometry to one S2- atom. The C–S bond length is 1.62 Å. S2- is bonded in a distorted bent 150 degrees geometry to two C4+ atoms. In each SnS cluster, Sn2+ is bonded in a single-bond geometry to one S2- atom. The Sn–S bond length is 2.32 Å. S2- is bonded in a distorted single-bond geometry to one Sn2+ atom.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1705344
Report Number(s):
mp-1179666
Country of Publication:
United States
Language:
English

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