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	hartrees
Energy at 0K	-154.401810
Energy at 298.15K	-154.406786
HF Energy	-154.401810
Nuclear repulsion energy	77.299100

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3242	3132	24.55
2	A	3139	3033	26.52
3	A	3089	2985	30.16
4	A	3060	2957	63.30
5	A	3003	2902	59.22
6	A	1519	1468	15.87
7	A	1510	1459	4.10
8	A	1504	1453	6.36
9	A	1469	1419	2.93
10	A	1290	1247	124.29
11	A	1261	1218	38.75
12	A	1180	1140	1.70
13	A	1148	1109	8.58
14	A	965	932	35.23
15	A	641	620	45.95
16	A	433	418	3.80
17	A	303	293	8.32
18	A	178	172	2.01

Atom	x (Å)	y (Å)	z (Å)
O1	0.091	-0.540	-0.043
C2	-1.139	0.168	0.015
C3	1.203	0.228	0.077
H4	-1.932	-0.564	-0.129
H5	-1.262	0.657	0.986
H6	-1.192	0.923	-0.779
H7	2.120	-0.336	-0.033
H8	1.147	1.264	-0.251

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4200	1.3559	2.0251	2.0790	2.0805	2.0389	2.1001
C2	1.4200		2.3431	1.0889	1.0951	1.0968	3.2977	2.5489
C3	1.3559	2.3431		3.2397	2.6619	2.6369	1.0822	1.0883
H4	2.0251	1.0889	3.2397		1.7848	1.7836	4.0593	3.5829
H5	2.0790	1.0951	2.6619	1.7848		1.7867	3.6691	2.7753
H6	2.0805	1.0968	2.6369	1.7836	1.7867		3.6212	2.4224
H7	2.0389	3.2977	1.0822	4.0593	3.6691	3.6212		1.8853
H8	2.1001	2.5489	1.0883	3.5829	2.7753	2.4224	1.8853

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	106.899	O1	C2	H5	110.843
O1	C2	H6	110.862	O1	C3	H7	113.013
O1	C3	H8	118.043	C2	O1	C3	115.130
H4	C2	H5	109.618	H4	C2	H6	109.381
H5	C2	H6	109.201	H7	C3	H8	120.583

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

using model chemistry: B3LYP/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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Number	Element	Mulliken
1	O	-0.260
2	C	-0.426
3	C	-0.316
4	H	0.218
5	H	0.205
6	H	0.200
7	H	0.202
8	H	0.178

	x	y	z	Total
	-0.893	0.998	-0.342	1.382
CHELPG
AIM
ESP

	x	y	z
x	5.079	0.096	-0.019
y	0.096	3.703	-0.092
z	-0.019	-0.092	3.238

<r²>	48.831
(<r²>)^1/2	6.988

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

using model chemistry: B3LYP/6-311G*

States and conformations

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