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	hartrees
Energy at 0K	-207.540647
Energy at 298.15K
HF Energy	-207.389033
Nuclear repulsion energy	102.730740

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'	3303	3303	2.32	61.43	0.67	0.81
2	A'	3216	3216	5.69	137.97	0.18	0.31
3	A'	3197	3197	1.19	27.94	0.19	0.32
4	A'	1685	1685	5.37	33.90	0.18	0.30
5	A'	1470	1470	18.54	24.33	0.37	0.54
6	A'	1350	1350	31.08	17.71	0.34	0.51
7	A'	1316	1316	11.29	22.01	0.33	0.49
8	A'	1155	1155	58.66	28.38	0.50	0.66
9	A'	905	905	32.24	0.44	0.74	0.85
10	A'	607	607	2.62	8.84	0.31	0.48
11	A'	346	346	1.43	0.34	0.70	0.82
12	A"	1030	1030	63.99	0.55	0.75	0.86
13	A"	1024	1024	5.00	1.88	0.75	0.86
14	A"	691	691	0.54	9.85	0.75	0.86
15	A"	190	190	0.15	1.17	0.75	0.86

Atom	x (Å)	y (Å)
C1	1.204	1.255
C2	0.000	0.656
N3	-0.018	-0.782
O4	-1.194	-1.269
H5	2.108	0.654
H6	1.309	2.333
H7	-0.959	1.167

	C1	C2	N3	O4	H5	H6	H7
C1		1.3445	2.3749	3.4812	1.0851	1.0834	2.1647
C2	1.3445		1.4379	2.2651	2.1076	2.1275	1.0868
N3	2.3749	1.4379		1.2731	2.5651	3.3857	2.1644
O4	3.4812	2.2651	1.2731		3.8209	4.3862	2.4474
H5	1.0851	2.1076	2.5651	3.8209		1.8591	3.1092
H6	1.0834	2.1275	3.3857	4.3862	1.8591		2.5501
H7	2.1647	1.0868	2.1644	2.4474	3.1092	2.5501

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	117.160	C1	C2	H7	125.491
C2	C1	H5	119.949	C2	C1	H6	122.016
C2	N3	O4	113.205	N3	C2	H7	117.349
H5	C1	H6	118.036

All results from a given calculation for C₂H₃NO (Nitrosoethylene)

using model chemistry: B2PLYP=FULL/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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All results from a given calculation for C2H3NO (Nitrosoethylene)

using model chemistry: B2PLYP=FULL/6-31G

States and conformations

All results from a given calculation for C₂H₃NO (Nitrosoethylene)