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	hartrees
Energy at 0K	-169.392748
Energy at 298.15K	-169.396436
HF Energy	-168.870488
Nuclear repulsion energy	70.150139

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3195	3035	9.07
2	A'	3072	2919	3.26
3	A'	1566	1488	19.80
4	A'	1477	1403	19.21
5	A'	1397	1327	25.37
6	A'	1170	1111	16.31
7	A'	899	854	14.72
8	A'	586	557	1.49
9	A"	3181	3023	4.63
10	A"	1482	1408	11.34
11	A"	992	942	4.40
12	A"	141	134	1.40

Atom	x (Å)	y (Å)	z (Å)
C1	-0.953	-0.558	0.000
N2	0.000	0.577	0.000
O3	1.163	0.213	0.000
H4	-0.423	-1.513	0.000
H5	-1.584	-0.442	0.885
H6	-1.584	-0.442	-0.885

	C1	N2	O3	H4	H5	H6
C1		1.4817	2.2518	1.0927	1.0932	1.0932
N2	1.4817		1.2191	2.1332	2.0808	2.0808
O3	2.2518	1.2191		2.3445	2.9593	2.9593
H4	1.0927	2.1332	2.3445		1.8107	1.8107
H5	1.0932	2.0808	2.9593	1.8107		1.7705
H6	1.0932	2.0808	2.9593	1.8107	1.7705

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.612	N2	C1	H4	111.011
N2	C1	H5	106.855	N2	C1	H6	106.855
H4	C1	H5	111.857	H4	C1	H6	111.857
H5	C1	H6	108.139

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: MP2/6-311G**

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 CH3NO (nitrosomethane)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)