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

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.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-723002
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Ag2H12S(NO)4; Ag-H-N-O-S
OSTI Identifier:
1287578
DOI:
10.17188/1287578

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Ag2H12S(NO)4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1287578.
Persson, Kristin, & Project, Materials. Materials Data on Ag2H12S(NO)4 by Materials Project. United States. doi:10.17188/1287578.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Ag2H12S(NO)4 by Materials Project". United States. doi:10.17188/1287578. https://www.osti.gov/servlets/purl/1287578. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1287578,
title = {Materials Data on Ag2H12S(NO)4 by Materials Project},
author = {Persson, Kristin and Project, Materials},
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 = {2020},
month = {5}
}

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