U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CuBr4(NO)2 by Materials Project
Abstract
Cu(OBr)2N2(Br)2 crystallizes in the tetragonal P4_2/mnm space group. The structure is one-dimensional and consists of four hydrobromic acid molecules; two Cu(OBr)2 ribbons oriented in the (0, 0, 1) direction; and two N2 ribbons oriented in the (0, 0, 1) direction. In each Cu(OBr)2 ribbon, Cu2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Cu–O bond lengths are 1.86 Å. O2- is bonded in a distorted trigonal planar geometry to one Cu2+ and two equivalent Br2+ atoms. Both O–Br bond lengths are 2.09 Å. Br2+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. In each N2 ribbon, N3- is bonded in a linear geometry to two equivalent N3- atoms. Both N–N bond lengths are 3.08 Å.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1213405
- 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; CuBr4(NO)2; Br-Cu-N-O
- OSTI Identifier:
- 1684565
- DOI:
- https://doi.org/10.17188/1684565
Citation Formats
The Materials Project. Materials Data on CuBr4(NO)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1684565.
The Materials Project. Materials Data on CuBr4(NO)2 by Materials Project. United States. doi:https://doi.org/10.17188/1684565
The Materials Project. 2020.
"Materials Data on CuBr4(NO)2 by Materials Project". United States. doi:https://doi.org/10.17188/1684565. https://www.osti.gov/servlets/purl/1684565. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1684565,
title = {Materials Data on CuBr4(NO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Cu(OBr)2N2(Br)2 crystallizes in the tetragonal P4_2/mnm space group. The structure is one-dimensional and consists of four hydrobromic acid molecules; two Cu(OBr)2 ribbons oriented in the (0, 0, 1) direction; and two N2 ribbons oriented in the (0, 0, 1) direction. In each Cu(OBr)2 ribbon, Cu2+ is bonded in a linear geometry to two equivalent O2- atoms. Both Cu–O bond lengths are 1.86 Å. O2- is bonded in a distorted trigonal planar geometry to one Cu2+ and two equivalent Br2+ atoms. Both O–Br bond lengths are 2.09 Å. Br2+ is bonded in a 2-coordinate geometry to two equivalent O2- atoms. In each N2 ribbon, N3- is bonded in a linear geometry to two equivalent N3- atoms. Both N–N bond lengths are 3.08 Å.},
doi = {10.17188/1684565},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}
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