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	hartrees
Energy at 0K	-207.289845
Energy at 298.15K
HF Energy	-206.672650
Nuclear repulsion energy	104.019417

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3293	3110	2.33
2	A'	3219	3040	3.96
3	A'	3196	3018	1.40
4	A'	1719	1623	1.47
5	A'	1623	1532	59.44
6	A'	1452	1371	10.83
7	A'	1314	1241	0.72
8	A'	1183	1117	45.15
9	A'	917	866	22.00
10	A'	618	583	1.43
11	A'	353	333	1.46
12	A"	1004	948	46.32
13	A"	978	923	13.05
14	A"	679	641	0.87
15	A"	164	155	0.02

Atom	x (Å)	y (Å)
C1	1.205	1.232
C2	0.000	0.649
N3	-0.035	-0.791
O4	-1.181	-1.231
H5	2.106	0.624
H6	1.318	2.312
H7	-0.961	1.164

	C1	C2	N3	O4	H5	H6	H7
C1		1.3381	2.3723	3.4286	1.0873	1.0862	2.1663
C2	1.3381		1.4406	2.2202	2.1064	2.1221	1.0896
N3	2.3723	1.4406		1.2276	2.5664	3.3853	2.1627
O4	3.4286	2.2202	1.2276		3.7744	4.3358	2.4046
H5	1.0873	2.1064	2.5664	3.7744		1.8628	3.1139
H6	1.0862	2.1221	3.3853	4.3358	1.8628		2.5520
H7	2.1663	1.0896	2.1627	2.4046	3.1139	2.5520

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	117.198	C1	C2	H7	126.019
C2	C1	H5	120.204	C2	C1	H6	121.825
C2	N3	O4	112.385	N3	C2	H7	116.784
H5	C1	H6	117.971

All results from a given calculation for C₂H₃NO (Nitrosoethylene)

using model chemistry: CCSD/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: CCSD/6-31G*

States and conformations

All results from a given calculation for C₂H₃NO (Nitrosoethylene)