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Title: Materials Data on ZnH8(N2Cl)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1279339· OSTI ID:1279339

ZnH8(N2Cl)2 crystallizes in the monoclinic C2/m space group. The structure is zero-dimensional and consists of two ZnH8(N2Cl)2 clusters. Zn2+ is bonded in an octahedral geometry to four equivalent N2- and two equivalent Cl1- atoms. All Zn–N bond lengths are 2.20 Å. Both Zn–Cl bond lengths are 2.57 Å. N2- is bonded in a distorted water-like geometry to one Zn2+ and two H1+ atoms. Both N–H bond lengths are 1.03 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one N2- atom. In the second H1+ site, H1+ is bonded in a single-bond geometry to one N2- atom. Cl1- is bonded in a single-bond geometry to one Zn2+ atom.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1279339
Report Number(s):
mp-632706
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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