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	hartrees
Energy at 0K	-169.802070
Energy at 298.15K	-169.806024
HF Energy	-169.802070
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3900	3690	109.48
2	A'	3265	3090	1.27
3	A'	3130	2961	2.02
4	A'	1760	1666	3.90
5	A'	1463	1384	14.06
6	A'	1368	1294	91.96
7	A'	1204	1139	11.69
8	A'	980	927	119.85
9	A'	548	519	6.51
10	A"	1021	966	39.13
11	A"	823	779	3.42
12	A"	413	391	158.83

Atom	x (Å)	y (Å)
C1	1.131	-0.027
N2	0.000	0.532
O3	-1.026	-0.402
H4	1.245	-1.108
H5	1.995	0.624
H6	-1.822	0.138

	C1	N2	O3	H4	H5	H6
C1		1.2616	2.1895	1.0875	1.0815	2.9583
N2	1.2616		1.3871	2.0592	1.9971	1.8645
O3	2.1895	1.3871		2.3784	3.1903	0.9622
H4	1.0875	2.0592	2.3784		1.8877	3.3110
H5	1.0815	1.9971	3.1903	1.8877		3.8482
H6	2.9583	1.8645	0.9622	3.3110	3.8482

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	111.418	N2	C1	H4	122.290
N2	C1	H5	116.720	N2	O3	H6	103.574
H4	C1	H5	120.990

All results from a given calculation for CH₂NOH (formaldoxime)

using model chemistry: M06-2X/TZVP

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	-0.165
2	N	-0.066
3	O	-0.342
4	H	0.125
5	H	0.140
6	H	0.307

	x	y	z	Total
	0.297	-0.067	0.000	0.305
CHELPG
AIM
ESP

	x	y	z
x	5.391	-0.176	0.000
y	-0.176	3.184	0.000
z	0.000	0.000	2.192

<r²>	40.371
(<r²>)^1/2	6.354

All results from a given calculation for CH2NOH (formaldoxime)

using model chemistry: M06-2X/TZVP

States and conformations

All results from a given calculation for CH₂NOH (formaldoxime)