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	hartrees
Energy at 0K	-169.370911
Energy at 298.15K	-169.374600
HF Energy	-168.853114
Nuclear repulsion energy	69.732516

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3190	3059	8.27
2	A'	3059	2934	2.64
3	A'	1528	1465	18.87
4	A'	1447	1387	22.08
5	A'	1366	1310	21.66
6	A'	1155	1108	14.18
7	A'	895	858	15.50
8	A'	575	551	1.75
9	A"	3169	3040	2.95
10	A"	1452	1392	11.02
11	A"	975	935	3.37
12	A"	151	145	1.09

Atom	x (Å)	y (Å)	z (Å)
C1	-0.960	-0.553	0.000
N2	0.000	0.578	0.000
O3	1.173	0.206	0.000
H4	-0.435	-1.520	0.000
H5	-1.596	-0.428	0.890
H6	-1.596	-0.428	-0.890

	C1	N2	O3	H4	H5	H6
C1		1.4835	2.2639	1.1001	1.1013	1.1013
N2	1.4835		1.2305	2.1429	2.0858	2.0858
O3	2.2639	1.2305		2.3594	2.9769	2.9769
H4	1.1001	2.1429	2.3594		1.8260	1.8260
H5	1.1013	2.0858	2.9769	1.8260		1.7797
H6	1.1013	2.0858	2.9769	1.8260	1.7797

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.724	N2	C1	H4	111.212
N2	C1	H5	106.664	N2	C1	H6	106.664
H4	C1	H5	112.087	H4	C1	H6	112.087
H5	C1	H6	107.808

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: MP2/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)