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	hartrees
Energy at 0K	-154.322654
Energy at 298.15K	-154.327601
HF Energy	-154.322654
Nuclear repulsion energy	77.469501

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3303	3145	13.57
2	A	3180	3028	18.80
3	A	3143	2993	25.23
4	A	3104	2956	48.00
5	A	3032	2888	58.30
6	A	1524	1451	21.11
7	A	1516	1444	2.12
8	A	1505	1433	9.89
9	A	1473	1403	4.22
10	A	1330	1266	179.05
11	A	1270	1209	19.72
12	A	1190	1133	2.04
13	A	1153	1098	7.04
14	A	995	948	34.11
15	A	588	560	57.44
16	A	443	422	4.07
17	A	283	270	7.07
18	A	182	173	3.51

Atom	x (Å)	y (Å)	z (Å)
O1	0.088	-0.534	-0.054
C2	-1.135	0.166	0.020
C3	1.200	0.225	0.078
H4	-1.932	-0.559	-0.148
H5	-1.262	0.627	1.007
H6	-1.188	0.948	-0.751
H7	2.122	-0.342	0.017
H8	1.161	1.255	-0.281

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4115	1.3524	2.0228	2.0730	2.0764	2.0443	2.0985
C2	1.4115		2.3360	1.0909	1.0966	1.0988	3.2964	2.5586
C3	1.3524	2.3360		3.2364	2.6617	2.6290	1.0843	1.0916
H4	2.0228	1.0909	3.2364		1.7861	1.7849	4.0635	3.5882
H5	2.0730	1.0966	2.6617	1.7861		1.7884	3.6567	2.8150
H6	2.0764	1.0988	2.6290	1.7849	1.7884		3.6347	2.4153
H7	2.0443	3.2964	1.0843	4.0635	3.6567	3.6347		1.8874
H8	2.0985	2.5586	1.0916	3.5882	2.8150	2.4153	1.8874

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.170	O1	C2	H5	110.862
O1	C2	H6	110.995	O1	C3	H7	113.601
O1	C3	H8	117.929	C2	O1	C3	115.362
H4	C2	H5	109.475	H4	C2	H6	109.201
H5	C2	H6	109.099	H7	C3	H8	120.316

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

using model chemistry: wB97X-D/6-31+G**

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	-0.263
2	C	-0.266
3	C	-0.222
4	H	0.166
5	H	0.158
6	H	0.146
7	H	0.152
8	H	0.128

	x	y	z	Total
	-0.958	1.141	-0.360	1.533
CHELPG
AIM
ESP

	x	y	z
x	5.262	0.163	0.041
y	0.163	3.978	-0.002
z	0.041	-0.002	4.033

<r²>	48.723
(<r²>)^1/2	6.980

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

using model chemistry: wB97X-D/6-31+G**

States and conformations

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