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Materials Data on PH2NO2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1285029· OSTI ID:1285029
NP(OH)2 crystallizes in the orthorhombic Cmme space group. The structure is two-dimensional and consists of one NP(OH)2 sheet oriented in the (0, 0, 1) direction. P5+ is bonded to two equivalent H1+ and two equivalent O2- atoms to form distorted PH2O2 tetrahedra that share corners with four equivalent NO4 tetrahedra. Both P–H bond lengths are 1.43 Å. Both P–O bond lengths are 1.52 Å. N3- is bonded to four equivalent O2- atoms to form distorted NO4 tetrahedra that share corners with four equivalent PH2O2 tetrahedra and edges with two equivalent NO4 tetrahedra. All N–O bond lengths are 2.81 Å. H1+ is bonded in a single-bond geometry to one P5+ atom. O2- is bonded in a single-bond geometry to one P5+ and two equivalent N3- atoms.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1285029
Report Number(s):
mp-696678
Country of Publication:
United States
Language:
English

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