Materials Data on HNO by Materials Project

Dataset · Sun May 03 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1697019· OSTI ID:1697019

The Materials Project

NHO crystallizes in the monoclinic C2/c space group. The structure is one-dimensional and consists of two NHO ribbons oriented in the (1, 0, 1) direction. there are two inequivalent N1+ sites. In the first N1+ site, N1+ is bonded in a distorted water-like geometry to one N1+ and two equivalent O2- atoms. The N–N bond length is 1.20 Å. Both N–O bond lengths are 1.38 Å. In the second N1+ site, N1+ is bonded in a distorted trigonal planar geometry to one N1+ and two equivalent H1+ atoms. Both N–H bond lengths are 1.61 Å. H1+ is bonded in a distorted linear geometry to one N1+ and one O2- atom. The H–O bond length is 1.05 Å. O2- is bonded in a distorted water-like geometry to one N1+ and one H1+ 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: 1697019
• Report Number(s): mp-1181155
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
HNO
H-N-O