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	hartrees
Energy at 0K	-207.394370
Energy at 298.15K
HF Energy	-206.727211
Nuclear repulsion energy	104.325083

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3281	3281	2.00
2	A'	3204	3204	4.77
3	A'	3178	3178	1.30
4	A'	1699	1699	2.90
5	A'	1645	1645	63.70
6	A'	1432	1432	10.87
7	A'	1291	1291	1.53
8	A'	1163	1163	47.61
9	A'	900	900	20.91
10	A'	618	618	0.98
11	A'	351	351	1.74
12	A"	1002	1002	38.44
13	A"	970	970	17.97
14	A"	677	677	1.33
15	A"	161	161	0.01

Atom	x (Å)	y (Å)
C1	1.208	1.228
C2	0.000	0.652
N3	-0.045	-0.792
O4	-1.176	-1.227
H5	2.098	0.606
H6	1.328	2.306
H7	-0.957	1.171

	C1	C2	N3	O4	H5	H6	H7
C1		1.3381	2.3770	3.4219	1.0863	1.0849	2.1657
C2	1.3381		1.4451	2.2169	2.0989	2.1213	1.0883
N3	2.3770	1.4451		1.2116	2.5586	3.3890	2.1644
O4	3.4219	2.2169	1.2116		3.7520	4.3307	2.4079
H5	1.0863	2.0989	2.5586	3.7520		1.8668	3.1071
H6	1.0849	2.1213	3.3890	4.3307	1.8668		2.5519
H7	2.1657	1.0883	2.1644	2.4079	3.1071	2.5519

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	117.255	C1	C2	H7	126.077
C2	C1	H5	119.565	C2	C1	H6	121.851
C2	N3	O4	112.826	N3	C2	H7	116.667
H5	C1	H6	118.584

All results from a given calculation for C₂H₃NO (Nitrosoethylene)

using model chemistry: CCSD/6-311G**

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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All results from a given calculation for C2H3NO (Nitrosoethylene)

using model chemistry: CCSD/6-311G**

States and conformations

All results from a given calculation for C₂H₃NO (Nitrosoethylene)