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Title: Materials Data on SbP(Cl2F3)2 by Materials Project

Abstract

SbF6PCl4 is beta-prime cadmium gold structured and crystallizes in the tetragonal P4/n space group. The structure is zero-dimensional and consists of two [pcl4]+1 molecules and two SbF6 clusters. In each SbF6 cluster, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is five shorter (1.92 Å) and one longer (1.93 Å) Sb–F bond length. 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 single-bond geometry to 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-559301
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; SbP(Cl2F3)2; Cl-F-P-Sb
OSTI Identifier:
1270793
DOI:
10.17188/1270793

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on SbP(Cl2F3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1270793.
Persson, Kristin, & Project, Materials. Materials Data on SbP(Cl2F3)2 by Materials Project. United States. doi:10.17188/1270793.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on SbP(Cl2F3)2 by Materials Project". United States. doi:10.17188/1270793. https://www.osti.gov/servlets/purl/1270793. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1270793,
title = {Materials Data on SbP(Cl2F3)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {SbF6PCl4 is beta-prime cadmium gold structured and crystallizes in the tetragonal P4/n space group. The structure is zero-dimensional and consists of two [pcl4]+1 molecules and two SbF6 clusters. In each SbF6 cluster, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is five shorter (1.92 Å) and one longer (1.93 Å) Sb–F bond length. 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 single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.},
doi = {10.17188/1270793},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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