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	hartrees
Energy at 0K	-154.198437
Energy at 298.15K	-154.203410
HF Energy	-154.198437
Nuclear repulsion energy	77.551945

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3289	3139	19.52
2	A	3175	3030	20.30
3	A	3133	2990	24.06
4	A	3098	2957	50.38
5	A	3028	2890	52.80
6	A	1516	1447	16.50
7	A	1511	1442	3.74
8	A	1498	1429	6.36
9	A	1467	1399	4.15
10	A	1325	1265	150.77
11	A	1265	1207	17.18
12	A	1179	1125	1.10
13	A	1148	1095	4.94
14	A	1004	958	30.25
15	A	644	614	38.82
16	A	434	414	3.95
17	A	298	284	8.42
18	A	176	168	1.72

Atom	x (Å)	y (Å)	z (Å)
O1	0.089	-0.543	-0.045
C2	-1.128	0.168	0.016
C3	1.194	0.228	0.076
H4	-1.931	-0.553	-0.144
H5	-1.258	0.647	0.994
H6	-1.175	0.939	-0.766
H7	2.118	-0.329	-0.019
H8	1.136	1.264	-0.257

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4109	1.3527	2.0227	2.0764	2.0771	2.0403	2.0988
C2	1.4109		2.3235	1.0910	1.0969	1.0989	3.2840	2.5299
C3	1.3527	2.3235		3.2287	2.6517	2.6126	1.0831	1.0892
H4	2.0227	1.0910	3.2287		1.7858	1.7841	4.0572	3.5665
H5	2.0764	1.0969	2.6517	1.7858		1.7855	3.6577	2.7706
H6	2.0771	1.0989	2.6126	1.7841	1.7855		3.6068	2.3886
H7	2.0403	3.2840	1.0831	4.0572	3.6577	3.6068		1.8861
H8	2.0988	2.5299	1.0892	3.5665	2.7706	2.3886	1.8861

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.204	O1	C2	H5	111.163
O1	C2	H6	111.097	O1	C3	H7	113.311
O1	C3	H8	118.118	C2	O1	C3	114.421
H4	C2	H5	109.411	H4	C2	H6	109.118
H5	C2	H6	108.809	H7	C3	H8	120.499

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

using model chemistry: HSEh1PBE/6-31G**

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	-0.411
2	C	-0.140
3	C	-0.084
4	H	0.147
5	H	0.134
6	H	0.125
7	H	0.125
8	H	0.103

	x	y	z	Total
	-0.806	1.026	-0.276	1.333
CHELPG
AIM
ESP

	x	y	z
x	4.840	0.097	0.015
y	0.097	3.535	-0.119
z	0.015	-0.119	2.815

<r²>	48.217
(<r²>)^1/2	6.944

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

using model chemistry: HSEh1PBE/6-31G**

States and conformations

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