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Title: Materials Data on ZnH16C4(Br2N)2 by Materials Project

Abstract

ZnBr4((CH3)2NH2)2 is Silicon tetrafluoride-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of eight dimethylazanium molecules and four ZnBr4 clusters. In each ZnBr4 cluster, Zn2+ is bonded in a tetrahedral geometry to four Br1- atoms. There are a spread of Zn–Br bond distances ranging from 2.42–2.48 Å. There are four inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the third Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the fourth Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom.

Authors:
Publication Date:
Other Number(s):
mp-567794
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; ZnH16C4(Br2N)2; Br-C-H-N-Zn
OSTI Identifier:
1274045
DOI:
https://doi.org/10.17188/1274045

Citation Formats

The Materials Project. Materials Data on ZnH16C4(Br2N)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1274045.
The Materials Project. Materials Data on ZnH16C4(Br2N)2 by Materials Project. United States. doi:https://doi.org/10.17188/1274045
The Materials Project. 2020. "Materials Data on ZnH16C4(Br2N)2 by Materials Project". United States. doi:https://doi.org/10.17188/1274045. https://www.osti.gov/servlets/purl/1274045. Pub date:Sun May 31 00:00:00 EDT 2020
@article{osti_1274045,
title = {Materials Data on ZnH16C4(Br2N)2 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnBr4((CH3)2NH2)2 is Silicon tetrafluoride-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of eight dimethylazanium molecules and four ZnBr4 clusters. In each ZnBr4 cluster, Zn2+ is bonded in a tetrahedral geometry to four Br1- atoms. There are a spread of Zn–Br bond distances ranging from 2.42–2.48 Å. There are four inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the third Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom. In the fourth Br1- site, Br1- is bonded in a single-bond geometry to one Zn2+ atom.},
doi = {10.17188/1274045},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}