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	hartrees
Energy at 0K	-154.330287
Energy at 298.15K	-154.335111
HF Energy	-154.330287
Nuclear repulsion energy	77.081080

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3200	3158	15.04
2	A	3080	3040	20.67
3	A	3049	3009	25.96
4	A	3002	2963	50.99
5	A	2943	2905	64.71
6	A	1473	1454	13.86
7	A	1461	1442	5.05
8	A	1457	1438	5.32
9	A	1426	1407	1.87
10	A	1246	1230	95.35
11	A	1218	1203	62.49
12	A	1144	1129	1.74
13	A	1112	1098	7.52
14	A	925	913	34.87
15	A	536	529	49.71
16	A	424	419	3.84
17	A	284	280	4.60
18	A	155	153	1.89

Atom	x (Å)	y (Å)	z (Å)
O1	0.093	-0.545	-0.034
C2	-1.142	0.170	0.011
C3	1.206	0.228	0.066
H4	-1.938	-0.566	-0.113
H5	-1.256	0.682	0.975
H6	-1.191	0.907	-0.802
H7	2.130	-0.325	-0.043
H8	1.133	1.279	-0.208

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4275	1.3589	2.0324	2.0838	2.0850	2.0496	2.1075
C2	1.4275		2.3493	1.0911	1.0974	1.0987	3.3103	2.5412
C3	1.3589	2.3493		3.2475	2.6628	2.6383	1.0832	1.0888
H4	2.0324	1.0911	3.2475		1.7908	1.7900	4.0763	3.5846
H5	2.0838	1.0974	2.6628	1.7908		1.7920	3.6764	2.7320
H6	2.0850	1.0987	2.6383	1.7900	1.7920		3.6235	2.4281
H7	2.0496	3.3103	1.0832	4.0763	3.6764	3.6235		1.8963
H8	2.1075	2.5412	1.0888	3.5846	2.7320	2.4281	1.8963

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.393	O1	C2	H5	110.928
O1	C2	H6	111.094	O1	C3	H7	113.714
O1	C3	H8	118.166	C2	O1	C3	115.539
H4	C2	H5	109.395	H4	C2	H6	109.140
H5	C2	H6	108.856	H7	C3	H8	120.253

All results from a given calculation for CH₃OCH₂ (methoxymethyl radical)

using model chemistry: B97D3/6-311+G(3df,2p)

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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Number	Element	Mulliken
1	O	-0.447
2	C	-0.014
3	C	-0.165
4	H	0.109
5	H	0.117
6	H	0.112
7	H	0.144
8	H	0.143

	x	y	z	Total
	-0.972	0.897	-0.318	1.360
CHELPG
AIM
ESP

	x	y	z
x	6.262	0.091	0.032
y	0.091	4.602	0.024
z	0.032	0.024	4.724

<r²>	49.194
(<r²>)^1/2	7.014

All results from a given calculation for CH3OCH2 (methoxymethyl radical)

using model chemistry: B97D3/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₃OCH₂ (methoxymethyl radical)