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	hartrees
Energy at 0K	-169.380921
Energy at 298.15K	-169.384555
HF Energy	-168.840468
Nuclear repulsion energy	69.794714

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3176	3059
2	A'	3049	2937
3	A'	1608	1549
4	A'	1449	1395
5	A'	1366	1316
6	A'	1142	1100
7	A'	859	827
8	A'	576	554
9	A"	3155	3039
10	A"	1454	1400
11	A"	963	927
12	A"	126	122

Atom	x (Å)	y (Å)	z (Å)
C1	-0.953	-0.571	0.000
N2	0.000	0.584	0.000
O3	1.164	0.224	0.000
H4	-0.409	-1.531	0.000
H5	-1.593	-0.462	0.893
H6	-1.593	-0.462	-0.893

	C1	N2	O3	H4	H5	H6
C1		1.4970	2.2609	1.1033	1.1044	1.1044
N2	1.4970		1.2180	2.1537	2.1042	2.1042
O3	2.2609	1.2180		2.3565	2.9777	2.9777
H4	1.1033	2.1537	2.3565		1.8284	1.8284
H5	1.1044	2.1042	2.9777	1.8284		1.7869
H6	1.1044	2.1042	2.9777	1.8284	1.7869

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	O3	112.360	N2	C1	H4	110.933
N2	C1	H5	107.003	N2	C1	H6	107.003
H4	C1	H5	111.826	H4	C1	H6	111.826
H5	C1	H6	107.995

All results from a given calculation for CH₃NO (nitrosomethane)

using model chemistry: CCSD(T)=FULL/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: CCSD(T)=FULL/cc-pVDZ

States and conformations

All results from a given calculation for CH₃NO (nitrosomethane)