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	hartrees
Energy at 0K	-244.474753
Energy at 298.15K	-244.479512
Nuclear repulsion energy	123.407899

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3201	3054	8.99
2	A'	3076	2935	16.26
3	A'	1715	1636	133.32
4	A'	1521	1451	9.12
5	A'	1479	1411	2.52
6	A'	1217	1162	0.69
7	A'	1065	1016	143.05
8	A'	886	846	80.67
9	A'	713	680	87.36
10	A'	374	357	2.36
11	A"	3153	3008	24.87
12	A"	1503	1434	7.50
13	A"	1188	1133	1.98
14	A"	350	334	2.82
15	A"	225	215	0.24

Atom	x (Å)	y (Å)	z (Å)
C1	1.317	0.317	0.000
O2	0.000	0.887	0.000
H3	1.983	1.179	0.000
H4	1.477	-0.296	0.892
H5	1.477	-0.296	-0.892
N6	-1.040	-0.035	0.000
O7	-0.695	-1.167	0.000

	C1	O2	H3	H4	H5	N6	O7
C1		1.4353	1.0894	1.0939	1.0939	2.3835	2.4993
O2	1.4353		2.0042	2.0921	2.0921	1.3902	2.1678
H3	1.0894	2.0042		1.7965	1.7965	3.2579	3.5595
H4	1.0939	2.0921	1.7965		1.7838	2.6834	2.5037
H5	1.0939	2.0921	1.7965	1.7838		2.6834	2.5037
N6	2.3835	1.3902	3.2579	2.6834	2.6834		1.1830
O7	2.4993	2.1678	3.5595	2.5037	2.5037	1.1830

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	N6	115.034	O2	C1	H3	104.259
O2	C1	H4	110.899	O2	C1	H5	110.899
O2	N6	O7	114.558	H3	C1	H4	110.740
H3	C1	H5	110.740	H4	C1	H5	109.241

All results from a given calculation for CH₃ONO (Methyl nitrite)

using model chemistry: QCISD/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 CH3ONO (Methyl nitrite)

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

States and conformations

All results from a given calculation for CH₃ONO (Methyl nitrite)