Materials Data on Ge2C2(SF2)3 by Materials Project

doi:10.17188/1264968

Title: Materials Data on Ge2C2(SF2)3 by Materials Project

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Abstract

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.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-541145

DOE Contract Number:: AC02-05CH11231; EDCBEE

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)

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; Ge2C2(SF2)3; C-F-Ge-S

OSTI Identifier:: 1264968

DOI:: https://doi.org/10.17188/1264968

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                    The Materials Project. Materials Data on Ge2C2(SF2)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1264968.

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                    The Materials Project. Materials Data on Ge2C2(SF2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1264968

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                    The Materials Project. 2020.  
"Materials Data on Ge2C2(SF2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1264968.  https://www.osti.gov/servlets/purl/1264968. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1264968,

  title        = {Materials Data on Ge2C2(SF2)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {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.},

  doi          = {10.17188/1264968},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1264968

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