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	hartrees
Energy at 0K	-207.725362
Energy at 298.15K
HF Energy	-207.725362
Nuclear repulsion energy	103.455756

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3301	3161	1.61
2	A'	3206	3071	6.53
3	A'	3188	3054	2.25
4	A'	1699	1627	4.76
5	A'	1477	1414	83.73
6	A'	1455	1393	29.71
7	A'	1312	1256	1.72
8	A'	1159	1110	59.46
9	A'	908	870	32.28
10	A'	615	589	3.34
11	A'	344	329	1.42
12	A"	1045	1001	27.81
13	A"	1029	986	48.55
14	A"	690	660	0.66
15	A"	195	186	0.24

Atom	x (Å)	y (Å)
C1	1.206	1.239
C2	0.000	0.654
N3	-0.030	-0.776
O4	-1.187	-1.255
H5	2.102	0.625
H6	1.324	2.316
H7	-0.954	1.177

	C1	C2	N3	O4	H5	H6	H7
C1		1.3404	2.3642	3.4564	1.0859	1.0841	2.1611
C2	1.3404		1.4308	2.2481	2.1023	2.1253	1.0880
N3	2.3642	1.4308		1.2519	2.5517	3.3763	2.1608
O4	3.4564	2.2481	1.2519		3.7886	4.3660	2.4432
H5	1.0859	2.1023	2.5517	3.7886		1.8614	3.1056
H6	1.0841	2.1253	3.3763	4.3660	1.8614		2.5474
H7	2.1611	1.0880	2.1608	2.4432	3.1056	2.5474

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	117.072	C1	C2	H7	125.416
C2	C1	H5	119.738	C2	C1	H6	122.118
C2	N3	O4	113.697	N3	C2	H7	117.512
H5	C1	H6	118.144

All results from a given calculation for C₂H₃NO (Nitrosoethylene)

using model chemistry: B3PW91/6-31G

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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Number	Element	Mulliken
1	C	-0.298
2	C	0.011
3	N	-0.015
4	O	-0.295
5	H	0.205
6	H	0.192
7	H	0.200

	x	y	z	Total
	1.584	3.386	0.000	3.738
CHELPG
AIM
ESP

<r²>	77.268
(<r²>)^1/2	8.790

All results from a given calculation for C2H3NO (Nitrosoethylene)

using model chemistry: B3PW91/6-31G

States and conformations

All results from a given calculation for C₂H₃NO (Nitrosoethylene)