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Title: Materials Data on Pd3(NO)16 by Materials Project

Abstract

Pd(PdN3)2(N2)2(NO2)2(NO3)4 crystallizes in the tetragonal I-42m space group. The structure is zero-dimensional and consists of eight ammonia molecules, eight nitric acid molecules, four nitrous acid molecules, two palladium molecules, and four PdN3 clusters. In each PdN3 cluster, Pd+2.67+ is bonded in a 1-coordinate geometry to three N+1.50+ atoms. There is one shorter (1.93 Å) and two longer (2.03 Å) Pd–N bond length. There are two inequivalent N+1.50+ sites. In the first N+1.50+ site, N+1.50+ is bonded in a single-bond geometry to one Pd+2.67+ atom. In the second N+1.50+ site, N+1.50+ is bonded in a 1-coordinate geometry to one Pd+2.67+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1202122
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; Pd3(NO)16; N-O-Pd
OSTI Identifier:
1697499
DOI:
https://doi.org/10.17188/1697499

Citation Formats

The Materials Project. Materials Data on Pd3(NO)16 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1697499.
The Materials Project. Materials Data on Pd3(NO)16 by Materials Project. United States. doi:https://doi.org/10.17188/1697499
The Materials Project. 2020. "Materials Data on Pd3(NO)16 by Materials Project". United States. doi:https://doi.org/10.17188/1697499. https://www.osti.gov/servlets/purl/1697499. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1697499,
title = {Materials Data on Pd3(NO)16 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd(PdN3)2(N2)2(NO2)2(NO3)4 crystallizes in the tetragonal I-42m space group. The structure is zero-dimensional and consists of eight ammonia molecules, eight nitric acid molecules, four nitrous acid molecules, two palladium molecules, and four PdN3 clusters. In each PdN3 cluster, Pd+2.67+ is bonded in a 1-coordinate geometry to three N+1.50+ atoms. There is one shorter (1.93 Å) and two longer (2.03 Å) Pd–N bond length. There are two inequivalent N+1.50+ sites. In the first N+1.50+ site, N+1.50+ is bonded in a single-bond geometry to one Pd+2.67+ atom. In the second N+1.50+ site, N+1.50+ is bonded in a 1-coordinate geometry to one Pd+2.67+ atom.},
doi = {10.17188/1697499},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat May 02 00:00:00 EDT 2020},
month = {Sat May 02 00:00:00 EDT 2020}
}