Materials Data on Ge2C2(SF2)3 by Materials Project

Dataset · Wed Jul 15 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1264968· OSTI ID:1264968

The Materials Project

Ge2C2(SF2)3 is diamond structured and crystallizes in the cubic Fd-3m space group. The structure is zero-dimensional and consists of eight 1,3,5,7-tetrakis(trifluoromethyl)-2,4,6,8,9,10-hexathia-1,3,5,7-tetragermatricyclo[3.3.1.1^{3,7}]decane molecules. Ge4+ is bonded in a trigonal non-coplanar geometry to three equivalent S2- atoms. All Ge–S bond lengths are 2.24 Å. C2+ is bonded in a trigonal non-coplanar geometry to three equivalent F1- atoms. All C–F bond lengths are 1.36 Å. S2- is bonded in a distorted water-like geometry to two equivalent Ge4+ and two equivalent F1- atoms. Both S–F bond lengths are 3.23 Å. F1- is bonded in a single-bond geometry to one C2+ and one S2- 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: 1264968
• Report Number(s): mp-541145
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Ge2C2(SF2)3
C-F-Ge-S