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	hartrees
Energy at 0K	-169.845240
Energy at 298.15K	-169.849090
HF Energy	-169.845240
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3664	3653	68.02
2	A'	3139	3129	6.06
3	A'	3015	3006	9.19
4	A'	1630	1625	5.39
5	A'	1408	1404	11.61
6	A'	1302	1298	79.36
7	A'	1137	1133	10.02
8	A'	835	833	119.91
9	A'	515	514	6.37
10	A"	928	925	31.56
11	A"	771	769	9.58
12	A"	417	415	112.89

Atom	x (Å)	y (Å)
C1	1.150	-0.012
N2	0.000	0.546
O3	-1.045	-0.430
H4	1.292	-1.096
H5	2.009	0.656
H6	-1.840	0.132

	C1	N2	O3	H4	H5	H6
C1		1.2781	2.2349	1.0935	1.0877	2.9937
N2	1.2781		1.4298	2.0894	2.0117	1.8862
O3	2.2349	1.4298		2.4306	3.2413	0.9732
H4	1.0935	2.0894	2.4306		1.8929	3.3644
H5	1.0877	2.0117	3.2413	1.8929		3.8844
H6	2.9937	1.8862	0.9732	3.3644	3.8844

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	111.110	N2	C1	H4	123.332
N2	C1	H5	116.260	N2	O3	H6	101.733
H4	C1	H5	120.408

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: BLYP/cc-pVTZ

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	C	-0.109
2	N	-0.045
3	O	-0.237
4	H	0.069
5	H	0.107
6	H	0.215

	x	y	z	Total
	0.206	-0.071	0.000	0.218
CHELPG
AIM
ESP

	x	y	z
x	5.915	-0.063	0.000
y	-0.063	3.504	0.000
z	0.000	0.000	2.286

<r²>	41.534
(<r²>)^1/2	6.445

All results from a given calculation for CH2NOH (formaldoxime)

using model chemistry: BLYP/cc-pVTZ

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)