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	hartrees
Energy at 0K	-207.686709
Energy at 298.15K
HF Energy	-207.476394
Nuclear repulsion energy	104.231400

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'	3316	3316	1.06	58.70	0.69	0.82
2	A'	3223	3223	4.66	142.98	0.17	0.28
3	A'	3207	3207	2.06	18.66	0.34	0.50
4	A'	1697	1697	2.38	27.91	0.17	0.29
5	A'	1538	1538	78.17	40.84	0.30	0.46
6	A'	1440	1440	19.75	23.50	0.38	0.55
7	A'	1302	1302	1.05	7.71	0.50	0.67
8	A'	1165	1165	67.77	24.87	0.50	0.66
9	A'	911	911	26.63	0.09	0.66	0.79
10	A'	614	614	1.68	6.93	0.27	0.43
11	A'	347	347	1.45	0.48	0.70	0.82
12	A"	1019	1019	36.03	0.11	0.75	0.86
13	A"	998	998	13.99	1.24	0.75	0.86
14	A"	688	688	0.40	8.06	0.75	0.86
15	A"	179	179	0.05	1.39	0.75	0.86

Atom	x (Å)	y (Å)
C1	1.206	1.224
C2	0.000	0.647
N3	-0.035	-0.780
O4	-1.183	-1.230
H5	2.094	0.604
H6	1.327	2.298
H7	-0.952	1.169

	C1	C2	N3	O4	H5	H6	H7
C1		1.3375	2.3574	3.4250	1.0825	1.0811	2.1593
C2	1.3375		1.4271	2.2182	2.0944	2.1190	1.0857
N3	2.3574	1.4271		1.2329	2.5394	3.3663	2.1534
O4	3.4250	2.2182	1.2329		3.7553	4.3301	2.4094
H5	1.0825	2.0944	2.5394	3.7553		1.8594	3.0979
H6	1.0811	2.1190	3.3663	4.3301	1.8594		2.5442
H7	2.1593	1.0857	2.1534	2.4094	3.0979	2.5442

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	116.980	C1	C2	H7	125.702
C2	C1	H5	119.497	C2	C1	H6	121.997
C2	N3	O4	112.806	N3	C2	H7	117.318
H5	C1	H6	118.506

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)