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Title: Materials Data on H18AuN6Cl by Materials Project

Abstract

(AuN2H6)2(NH3)8Cl2 is Ammonia-derived structured and crystallizes in the orthorhombic Pbcn space group. The structure is zero-dimensional and consists of sixteen ammonia molecules, four hydrochloric acid molecules, and four AuN2H6 clusters. In each AuN2H6 cluster, Au1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Au–N bond lengths are 2.06 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Au1+ and three H1+ atoms. There are a spread of N–H bond distances ranging from 1.02–1.05 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom.

Authors:
Publication Date:
Other Number(s):
mp-1199528
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; H18AuN6Cl; Au-Cl-H-N
OSTI Identifier:
1695444
DOI:
https://doi.org/10.17188/1695444

Citation Formats

The Materials Project. Materials Data on H18AuN6Cl by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1695444.
The Materials Project. Materials Data on H18AuN6Cl by Materials Project. United States. doi:https://doi.org/10.17188/1695444
The Materials Project. 2019. "Materials Data on H18AuN6Cl by Materials Project". United States. doi:https://doi.org/10.17188/1695444. https://www.osti.gov/servlets/purl/1695444. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1695444,
title = {Materials Data on H18AuN6Cl by Materials Project},
author = {The Materials Project},
abstractNote = {(AuN2H6)2(NH3)8Cl2 is Ammonia-derived structured and crystallizes in the orthorhombic Pbcn space group. The structure is zero-dimensional and consists of sixteen ammonia molecules, four hydrochloric acid molecules, and four AuN2H6 clusters. In each AuN2H6 cluster, Au1+ is bonded in a linear geometry to two equivalent N3- atoms. Both Au–N bond lengths are 2.06 Å. N3- is bonded in a distorted trigonal non-coplanar geometry to one Au1+ and three H1+ atoms. There are a spread of N–H bond distances ranging from 1.02–1.05 Å. There are three inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N3- atom.},
doi = {10.17188/1695444},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}