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	hartrees
Energy at 0K	-129.906556
Energy at 298.15K
HF Energy	-129.906556
Nuclear repulsion energy	37.956517

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3773	3773	29.83	43.98	0.31	0.47
2	A'	3412	3412	18.70	57.34	0.11	0.20
3	A'	1847	1847	2.76	14.32	0.70	0.82
4	A'	1563	1563	6.68	9.84	0.74	0.85
5	A'	1261	1261	53.07	2.75	0.74	0.85
6	A'	1157	1157	9.91	7.89	0.15	0.27
7	A"	3598	3598	27.30	33.92	0.75	0.86
8	A"	1388	1388	2.71	10.11	0.75	0.86
9	A"	238	238	120.83	7.87	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	-0.016	0.724	0.000
O2	-0.016	-0.756	0.000
H3	-1.030	-0.907	0.000
H4	0.636	0.943	0.823
H5	0.636	0.943	-0.823

	N1	O2	H3	H4	H5
N1		1.4798	1.9201	1.0724	1.0724
O2	1.4798		1.0251	1.9974	1.9974
H3	1.9201	1.0251		2.6220	2.6220
H4	1.0724	1.9974	2.6220		1.6451
H5	1.0724	1.9974	2.6220	1.6451

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H3	98.450		O2	N1	H4	101.813
O2	N1	H5	101.813		H4	N1	H5	100.173

All results from a given calculation for NH₂OH (hydroxylamine)

using model chemistry: wB97X-D/STO-3G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	N	-0.287
2	O	-0.205
3	H	0.185
4	H	0.153
5	H	0.153

	x	y	z	Total
	0.430	0.161	0.000	0.460
CHELPG
AIM
ESP

	x	y	z
x	1.086	0.596	0.000
y	0.596	1.352	0.000
z	0.000	0.000	0.887

<r²>	20.753
(<r²>)^1/2	4.556

All results from a given calculation for NH2OH (hydroxylamine)

using model chemistry: wB97X-D/STO-3G

States and conformations

All results from a given calculation for NH₂OH (hydroxylamine)