skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on NiH24C4S4N8(ClO4)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1666801· OSTI ID:1666801

Ni(N2H4)2Cl2(CNH4SO2)4 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four methanesulfonamide molecules and one Ni(N2H4)2Cl2 cluster. In the Ni(N2H4)2Cl2 cluster, Ni2+ is bonded in an octahedral geometry to four N2- and two equivalent Cl1- atoms. All Ni–N bond lengths are 2.20 Å. Both Ni–Cl bond lengths are 2.42 Å. There are two inequivalent N2- sites. In the first N2- site, N2- is bonded in a distorted water-like geometry to one Ni2+ and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. In the second N2- site, N2- is bonded in a distorted water-like geometry to one Ni2+ and two H1+ atoms. There is one shorter (1.02 Å) and one longer (1.03 Å) N–H bond length. There are four 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. In the third H1+ site, H1+ is bonded in a single-bond geometry to one N2- atom. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one N2- atom. Cl1- is bonded in a single-bond geometry to one Ni2+ 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:
1666801
Report Number(s):
mp-1205229
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on NiH18C4S6(N2O)4 by Materials Project
Dataset · Sat May 02 00:00:00 EDT 2020 · OSTI ID:1666801

Materials Data on NiH24C6S6(N7O3)2 by Materials Project
Dataset · Sat Jan 12 00:00:00 EST 2019 · OSTI ID:1666801

Materials Data on NiH24C6S6(BrN6)2 by Materials Project
Dataset · Sat Jan 12 00:00:00 EST 2019 · OSTI ID:1666801