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	hartrees
Energy at 0K	-169.345153
Energy at 298.15K	-169.348857
HF Energy	-168.834218
Nuclear repulsion energy	69.919986

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3248	3050	7.74
2	A'	3116	2927	2.55
3	A'	1546	1452	12.21
4	A'	1502	1411	24.45
5	A'	1423	1336	27.50
6	A'	1182	1110	13.30
7	A'	916	860	13.54
8	A'	585	549	1.81
9	A"	3231	3034	2.63
10	A"	1508	1416	12.65
11	A"	1004	943	4.59
12	A"	150	140	1.31

Atom	x (Å)	y (Å)	z (Å)
C1	-0.961	-0.543	0.000
N2	0.000	0.576	0.000
O3	1.175	0.195	0.000
H4	-0.450	-1.503	0.000
H5	-1.589	-0.418	0.881
H6	-1.589	-0.418	-0.881

	C1	N2	O3	H4	H5	H6
C1		1.4754	2.2600	1.0878	1.0887	1.0887
N2	1.4754		1.2347	2.1274	2.0707	2.0707
O3	2.2600	1.2347		2.3504	2.9644	2.9644
H4	1.0878	2.1274	2.3504		1.8032	1.8032
H5	1.0887	2.0707	2.9644	1.8032		1.7616
H6	1.0887	2.0707	2.9644	1.8032	1.7616

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.704	N2	C1	H4	111.293
N2	C1	H5	106.746	N2	C1	H6	106.746
H4	C1	H5	111.882	H4	C1	H6	111.882
H5	C1	H6	108.003

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: MP2=FULL/6-31+G**

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 CH3NO (nitrosomethane)

using model chemistry: MP2=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)