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Title: Materials Data on Zn(N3O8)2 by Materials Project

Abstract

ZnO8N2(NO2)4 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four ammonia molecules; eight hydroxylamine, n-hydroxy- molecules; and two ZnO8 clusters. In each ZnO8 cluster, Zn2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Zn–O bond lengths are 1.87 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted water-like geometry to one Zn2+ and one O2- atom. The O–O bond length is 1.32 Å. In the second O2- site, O2- is bonded in a distorted water-like geometry to two O2- atoms. There is one shorter (1.21 Å) and one longer (1.72 Å) O–O bond length. In the third O2- site, O2- is bonded in a distorted water-like geometry to two O2- atoms. In the fourth O2- site, O2- is bonded in a single-bond geometry to one O2- atom.

Authors:
Publication Date:
Other Number(s):
mp-1178866
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; Zn(N3O8)2; N-O-Zn
OSTI Identifier:
1695386
DOI:
https://doi.org/10.17188/1695386

Citation Formats

The Materials Project. Materials Data on Zn(N3O8)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1695386.
The Materials Project. Materials Data on Zn(N3O8)2 by Materials Project. United States. doi:https://doi.org/10.17188/1695386
The Materials Project. 2020. "Materials Data on Zn(N3O8)2 by Materials Project". United States. doi:https://doi.org/10.17188/1695386. https://www.osti.gov/servlets/purl/1695386. Pub date:Fri May 01 00:00:00 EDT 2020
@article{osti_1695386,
title = {Materials Data on Zn(N3O8)2 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnO8N2(NO2)4 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four ammonia molecules; eight hydroxylamine, n-hydroxy- molecules; and two ZnO8 clusters. In each ZnO8 cluster, Zn2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Zn–O bond lengths are 1.87 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted water-like geometry to one Zn2+ and one O2- atom. The O–O bond length is 1.32 Å. In the second O2- site, O2- is bonded in a distorted water-like geometry to two O2- atoms. There is one shorter (1.21 Å) and one longer (1.72 Å) O–O bond length. In the third O2- site, O2- is bonded in a distorted water-like geometry to two O2- atoms. In the fourth O2- site, O2- is bonded in a single-bond geometry to one O2- atom.},
doi = {10.17188/1695386},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}