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Title: Materials Data on NbSNCl6 by Materials Project

Abstract

NbCl5NSCl crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four niobium(v) chloride molecules and four NSCl clusters. In each NSCl cluster, N3+ is bonded in a single-bond geometry to one S2- atom. The N–S bond length is 1.46 Å. S2- is bonded in a distorted bent 120 degrees geometry to one N3+ and one Cl1- atom. The S–Cl bond length is 2.14 Å. Cl1- is bonded in a single-bond geometry to one S2- atom.

Authors:
Publication Date:
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)
Contributing Org.:
MIT; UC Berkeley; Duke; U Louvain
OSTI Identifier:
1277626
Report Number(s):
mp-608398
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; NbSNCl6; Cl-N-Nb-S

Citation Formats

The Materials Project. Materials Data on NbSNCl6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1277626.
The Materials Project. Materials Data on NbSNCl6 by Materials Project. United States. https://doi.org/10.17188/1277626
The Materials Project. 2020. "Materials Data on NbSNCl6 by Materials Project". United States. https://doi.org/10.17188/1277626. https://www.osti.gov/servlets/purl/1277626.
@article{osti_1277626,
title = {Materials Data on NbSNCl6 by Materials Project},
author = {The Materials Project},
abstractNote = {NbCl5NSCl crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four niobium(v) chloride molecules and four NSCl clusters. In each NSCl cluster, N3+ is bonded in a single-bond geometry to one S2- atom. The N–S bond length is 1.46 Å. S2- is bonded in a distorted bent 120 degrees geometry to one N3+ and one Cl1- atom. The S–Cl bond length is 2.14 Å. Cl1- is bonded in a single-bond geometry to one S2- atom.},
doi = {10.17188/1277626},
url = {https://www.osti.gov/biblio/1277626}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri May 01 00:00:00 EDT 2020},
month = {Fri May 01 00:00:00 EDT 2020}
}