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Title: Materials Data on AgSbC2N2(ClF3)2 by Materials Project

Abstract

AgC2SbN2(ClF3)2 crystallizes in the monoclinic P2/c space group. The structure is one-dimensional and consists of two AgC2SbN2(ClF3)2 ribbons oriented in the (0, 1, 0) direction. Ag1+ is bonded in a square co-planar geometry to two equivalent N3- and two equivalent F1- atoms. Both Ag–N bond lengths are 2.09 Å. Both Ag–F bond lengths are 2.82 Å. C4+ is bonded in a linear geometry to one N3- and one Cl1- atom. The C–N bond length is 1.17 Å. The C–Cl bond length is 1.60 Å. Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is four shorter (1.92 Å) and two longer (1.94 Å) Sb–F bond length. N3- is bonded in a distorted linear geometry to one Ag1+ and one C4+ atom. Cl1- is bonded in a distorted single-bond geometry to one C4+ atom. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to one Ag1+ and one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-556201
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; AgSbC2N2(ClF3)2; Ag-C-Cl-F-N-Sb
OSTI Identifier:
1269224
DOI:
10.17188/1269224

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on AgSbC2N2(ClF3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1269224.
Persson, Kristin, & Project, Materials. Materials Data on AgSbC2N2(ClF3)2 by Materials Project. United States. doi:10.17188/1269224.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on AgSbC2N2(ClF3)2 by Materials Project". United States. doi:10.17188/1269224. https://www.osti.gov/servlets/purl/1269224. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1269224,
title = {Materials Data on AgSbC2N2(ClF3)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {AgC2SbN2(ClF3)2 crystallizes in the monoclinic P2/c space group. The structure is one-dimensional and consists of two AgC2SbN2(ClF3)2 ribbons oriented in the (0, 1, 0) direction. Ag1+ is bonded in a square co-planar geometry to two equivalent N3- and two equivalent F1- atoms. Both Ag–N bond lengths are 2.09 Å. Both Ag–F bond lengths are 2.82 Å. C4+ is bonded in a linear geometry to one N3- and one Cl1- atom. The C–N bond length is 1.17 Å. The C–Cl bond length is 1.60 Å. Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is four shorter (1.92 Å) and two longer (1.94 Å) Sb–F bond length. N3- is bonded in a distorted linear geometry to one Ag1+ and one C4+ atom. Cl1- is bonded in a distorted single-bond geometry to one C4+ atom. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to one Ag1+ and one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.},
doi = {10.17188/1269224},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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