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	hartrees
Energy at 0K	-244.370983
Energy at 298.15K	-244.375729
HF Energy	-243.681838
Nuclear repulsion energy	122.815230

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3246	3092	5.91
2	A'	3092	2945	15.27
3	A'	1602	1526	97.46
4	A'	1495	1424	8.33
5	A'	1443	1374	2.80
6	A'	1189	1133	1.09
7	A'	1049	999	125.53
8	A'	876	834	103.56
9	A'	680	648	151.08
10	A'	369	352	1.40
11	A"	3186	3035	21.12
12	A"	1480	1410	8.45
13	A"	1166	1110	1.33
14	A"	373	355	2.05
15	A"	225	214	0.27

Atom	x (Å)	y (Å)	z (Å)
C1	1.310	0.313	0.000
O2	0.000	0.898	0.000
H3	1.993	1.171	0.000
H4	1.468	-0.309	0.896
H5	1.468	-0.309	-0.896
N6	-1.044	-0.031	0.000
O7	-0.685	-1.175	0.000

	C1	O2	H3	H4	H5	N6	O7
C1		1.4350	1.0966	1.1021	1.1021	2.3797	2.4896
O2	1.4350		2.0120	2.1012	2.1012	1.3982	2.1841
H3	1.0966	2.0120		1.8084	1.8084	3.2671	3.5610
H4	1.1021	2.1012	1.8084		1.7913	2.6814	2.4874
H5	1.1021	2.1012	1.8084	1.7913		2.6814	2.4874
N6	2.3797	1.3982	3.2671	2.6814	2.6814		1.1992
O7	2.4896	2.1841	3.5610	2.4874	2.4874	1.1992

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	N6	114.262	O2	C1	H3	104.468
O2	C1	H4	111.147	O2	C1	H5	111.147
O2	N6	O7	114.245	H3	C1	H4	110.668
H3	C1	H5	110.668	H4	C1	H5	108.718

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

using model chemistry: MP2/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 CH3ONO (Methyl nitrite)

using model chemistry: MP2/cc-pVDZ

States and conformations

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