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	hartrees
Energy at 0K	-131.000589
Energy at 298.15K
HF Energy	-131.000589
Nuclear repulsion energy	40.241646

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'	4179	3784	60.89	53.75	0.29	0.44
2	A'	3708	3358	1.85	90.24	0.12	0.22
3	A'	1822	1650	15.97	5.67	0.62	0.76
4	A'	1541	1396	35.45	1.82	0.75	0.86
5	A'	1253	1135	157.96	3.39	0.63	0.77
6	A'	1121	1015	20.95	15.89	0.20	0.33
7	A"	3794	3435	1.26	52.26	0.75	0.86
8	A"	1467	1329	0.24	4.98	0.75	0.86
9	A"	436	394	186.74	2.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	-0.009	0.683	0.000
O2	-0.009	-0.715	0.000
H3	-0.919	-0.948	0.000
H4	0.527	0.947	0.803
H5	0.527	0.947	-0.803

	N1	O2	H3	H4	H5
N1		1.3980	1.8679	1.0010	1.0010
O2	1.3980		0.9398	1.9221	1.9221
H3	1.8679	0.9398		2.5157	2.5157
H4	1.0010	1.9221	2.5157		1.6057
H5	1.0010	1.9221	2.5157	1.6057

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H3	104.355		O2	N1	H4	105.294
O2	N1	H5	105.294		H4	N1	H5	106.662

All results from a given calculation for NH₂OH (hydroxylamine)

using model chemistry: HF/6-31G(2df,p)

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	N	-0.363
2	O	-0.549
3	H	0.346
4	H	0.283
5	H	0.283

	x	y	z	Total
	0.061	0.618	0.000	0.621
CHELPG
AIM
ESP

	x	y	z
x	1.701	0.387	0.000
y	0.387	2.310	0.000
z	0.000	0.000	1.726

<r²>	19.842
(<r²>)^1/2	4.454

All results from a given calculation for NH2OH (hydroxylamine)

using model chemistry: HF/6-31G(2df,p)

States and conformations

All results from a given calculation for NH₂OH (hydroxylamine)