Materials Data on Ag2H12S(NO)4 by Materials Project

doi:10.17188/1287578

Title: Materials Data on Ag2H12S(NO)4 by Materials Project

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Abstract

(Ag(NH3)2)2SO4 crystallizes in the tetragonal P-42_1c space group. The structure is zero-dimensional and consists of two sulfuric acid molecules and four Ag(NH3)2 clusters. In each Ag(NH3)2 cluster, Ag1+ is bonded in a linear geometry to two equivalent N1- atoms. Both Ag–N bond lengths are 2.14 Å. N1- is bonded in a distorted trigonal non-coplanar geometry to one Ag1+ and three H1+ atoms. All N–H bond lengths are 1.03 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom.

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-723002

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; Ag-H-N-O-S; Ag2H12S(NO)4; crystal structure

OSTI Identifier:: 1287578

DOI:: https://doi.org/10.17188/1287578

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                    Materials Data on Ag2H12S(NO)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1287578.

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                    Materials Data on Ag2H12S(NO)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1287578

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                    2020.  
"Materials Data on Ag2H12S(NO)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1287578.  https://www.osti.gov/servlets/purl/1287578. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1287578,

  title        = {Materials Data on Ag2H12S(NO)4 by Materials Project},

  
  abstractNote = {(Ag(NH3)2)2SO4 crystallizes in the tetragonal P-42_1c space group. The structure is zero-dimensional and consists of two sulfuric acid molecules and four Ag(NH3)2 clusters. In each Ag(NH3)2 cluster, Ag1+ is bonded in a linear geometry to two equivalent N1- atoms. Both Ag–N bond lengths are 2.14 Å. N1- is bonded in a distorted trigonal non-coplanar geometry to one Ag1+ and three H1+ atoms. All N–H bond lengths are 1.03 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N1- atom.},

  doi          = {10.17188/1287578},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1287578

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