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Title: Materials Data on Sb2ClF17 by Materials Project

Abstract

Sb2F11ClF6 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four ClF6 clusters and four Sb2F11 clusters. In each ClF6 cluster, Cl is bonded in an octahedral geometry to six equivalent F atoms. All Cl–F bond lengths are 1.61 Å. F is bonded in a single-bond geometry to one Cl atom. In each Sb2F11 cluster, there are two inequivalent Sb sites. In the first Sb site, Sb is bonded to six F atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 35°. There are a spread of Sb–F bond distances ranging from 1.90–2.08 Å. In the second Sb site, Sb is bonded to six F atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 35°. There are a spread of Sb–F bond distances ranging from 1.90–2.09 Å. There are eleven inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to one Sb atom. In the second F site, F is bonded in a single-bond geometry to one Sb atom. In the third F site, F is bonded in a single-bond geometry to one Sb atom. In the fourth F site, F is bondedmore » in a single-bond geometry to one Sb atom. In the fifth F site, F is bonded in a single-bond geometry to one Sb atom. In the sixth F site, F is bonded in a single-bond geometry to one Sb atom. In the seventh F site, F is bonded in a single-bond geometry to one Sb atom. In the eighth F site, F is bonded in a single-bond geometry to one Sb atom. In the ninth F site, F is bonded in a single-bond geometry to one Sb atom. In the tenth F site, F is bonded in a single-bond geometry to one Sb atom. In the eleventh F site, F is bonded in a bent 150 degrees geometry to two Sb atoms.« less

Publication Date:
Other Number(s):
mp-559349
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; Sb2ClF17; Cl-F-Sb
OSTI Identifier:
1270816
DOI:
https://doi.org/10.17188/1270816

Citation Formats

The Materials Project. Materials Data on Sb2ClF17 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1270816.
The Materials Project. Materials Data on Sb2ClF17 by Materials Project. United States. doi:https://doi.org/10.17188/1270816
The Materials Project. 2017. "Materials Data on Sb2ClF17 by Materials Project". United States. doi:https://doi.org/10.17188/1270816. https://www.osti.gov/servlets/purl/1270816. Pub date:Thu May 11 00:00:00 EDT 2017
@article{osti_1270816,
title = {Materials Data on Sb2ClF17 by Materials Project},
author = {The Materials Project},
abstractNote = {Sb2F11ClF6 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four ClF6 clusters and four Sb2F11 clusters. In each ClF6 cluster, Cl is bonded in an octahedral geometry to six equivalent F atoms. All Cl–F bond lengths are 1.61 Å. F is bonded in a single-bond geometry to one Cl atom. In each Sb2F11 cluster, there are two inequivalent Sb sites. In the first Sb site, Sb is bonded to six F atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 35°. There are a spread of Sb–F bond distances ranging from 1.90–2.08 Å. In the second Sb site, Sb is bonded to six F atoms to form corner-sharing SbF6 octahedra. The corner-sharing octahedral tilt angles are 35°. There are a spread of Sb–F bond distances ranging from 1.90–2.09 Å. There are eleven inequivalent F sites. In the first F site, F is bonded in a single-bond geometry to one Sb atom. In the second F site, F is bonded in a single-bond geometry to one Sb atom. In the third F site, F is bonded in a single-bond geometry to one Sb atom. In the fourth F site, F is bonded in a single-bond geometry to one Sb atom. In the fifth F site, F is bonded in a single-bond geometry to one Sb atom. In the sixth F site, F is bonded in a single-bond geometry to one Sb atom. In the seventh F site, F is bonded in a single-bond geometry to one Sb atom. In the eighth F site, F is bonded in a single-bond geometry to one Sb atom. In the ninth F site, F is bonded in a single-bond geometry to one Sb atom. In the tenth F site, F is bonded in a single-bond geometry to one Sb atom. In the eleventh F site, F is bonded in a bent 150 degrees geometry to two Sb atoms.},
doi = {10.17188/1270816},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}