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	hartrees
Energy at 0K	-244.380096
Energy at 298.15K	-244.384846
HF Energy	-243.682100
Nuclear repulsion energy	122.891664

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3252	3091	5.75
2	A'	3097	2944	15.18
3	A'	1605	1525	97.80
4	A'	1498	1423	8.40
5	A'	1445	1373	2.81
6	A'	1191	1132	1.07
7	A'	1051	999	124.73
8	A'	877	833	103.27
9	A'	681	647	151.65
10	A'	370	351	1.41
11	A"	3193	3034	20.81
12	A"	1482	1409	8.60
13	A"	1167	1109	1.29
14	A"	374	355	2.05
15	A"	225	214	0.27

Atom	x (Å)	y (Å)	z (Å)
C1	1.309	0.314	0.000
O2	0.000	0.898	0.000
H3	1.992	1.171	0.000
H4	1.467	-0.308	0.895
H5	1.467	-0.308	-0.895
N6	-1.044	-0.031	0.000
O7	-0.685	-1.175	0.000

	C1	O2	H3	H4	H5	N6	O7
C1		1.4338	1.0956	1.1011	1.1011	2.3782	2.4884
O2	1.4338		2.0107	2.0995	2.0995	1.3974	2.1830
H3	1.0956	2.0107		1.8065	1.8065	3.2651	3.5590
H4	1.1011	2.0995	1.8065		1.7894	2.6798	2.4863
H5	1.1011	2.0995	1.8065	1.7894		2.6798	2.4863
N6	2.3782	1.3974	3.2651	2.6798	2.6798		1.1986
O7	2.4884	2.1830	3.5590	2.4863	2.4863	1.1986

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	N6	114.276	O2	C1	H3	104.502
O2	C1	H4	111.163	O2	C1	H5	111.163
O2	N6	O7	114.250	H3	C1	H4	110.646
H3	C1	H5	110.646	H4	C1	H5	108.697

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

using model chemistry: MP2=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 CH3ONO (Methyl nitrite)

using model chemistry: MP2=FULL/cc-pVDZ

States and conformations

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