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	hartrees
Energy at 0K	-131.051411
Energy at 298.15K
HF Energy	-131.051411
Nuclear repulsion energy	39.394629

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'	3667	3597	25.40	71.08	0.30	0.46
2	A'	3325	3262	4.66	120.86	0.12	0.21
3	A'	1649	1618	15.59	16.32	0.52	0.68
4	A'	1397	1370	22.47	5.86	0.75	0.86
5	A'	1145	1124	147.90	3.88	0.75	0.86
6	A'	963	944	17.58	7.43	0.17	0.29
7	A"	3421	3356	1.41	70.11	0.75	0.86
8	A"	1315	1290	0.35	12.93	0.75	0.86
9	A"	435	427	190.82	5.33	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
N1	-0.011	0.695	0.000
O2	-0.011	-0.728	0.000
H3	-0.967	-0.929	0.000
H4	0.566	0.945	0.817
H5	0.566	0.945	-0.817

	N1	O2	H3	H4	H5
N1		1.4226	1.8843	1.0313	1.0313
O2	1.4226		0.9773	1.9492	1.9492
H3	1.8843	0.9773		2.5554	2.5554
H4	1.0313	1.9492	2.5554		1.6348
H5	1.0313	1.9492	2.5554	1.6348

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H3	101.866		O2	N1	H4	104.050
O2	N1	H5	104.050		H4	N1	H5	104.865

All results from a given calculation for NH₂OH (hydroxylamine)

using model chemistry: SVWN/6-31G*

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	-0.544
2	O	-0.539
3	H	0.423
4	H	0.330
5	H	0.330

	x	y	z	Total
	0.152	0.498	0.000	0.520
CHELPG
AIM
ESP

	x	y	z
x	1.708	0.485	0.000
y	0.485	2.150	0.000
z	0.000	0.000	1.660

<r²>	20.411
(<r²>)^1/2	4.518

All results from a given calculation for NH2OH (hydroxylamine)

using model chemistry: SVWN/6-31G*

States and conformations

All results from a given calculation for NH₂OH (hydroxylamine)