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	hartrees
Energy at 0K	-154.325754
Energy at 298.15K	-154.330717
HF Energy	-154.325754
Nuclear repulsion energy	77.782009

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3277	3146	16.93
2	A	3167	3041	20.77
3	A	3120	2995	23.82
4	A	3090	2967	52.83
5	A	3025	2904	53.60
6	A	1507	1447	18.56
7	A	1499	1439	3.68
8	A	1489	1429	8.61
9	A	1458	1400	2.54
10	A	1321	1268	148.67
11	A	1260	1210	19.42
12	A	1175	1128	1.59
13	A	1144	1098	5.54
14	A	996	956	33.30
15	A	603	579	47.87
16	A	425	408	3.47
17	A	308	295	6.69
18	A	174	167	1.91

Atom	x (Å)	y (Å)	z (Å)
O1	0.091	-0.541	-0.039
C2	-1.127	0.167	0.013
C3	1.192	0.227	0.071
H4	-1.925	-0.556	-0.130
H5	-1.249	0.659	0.982
H6	-1.174	0.920	-0.780
H7	2.113	-0.325	-0.034
H8	1.122	1.267	-0.231

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4095	1.3467	2.0179	2.0681	2.0692	2.0341	2.0901
C2	1.4095		2.3201	1.0867	1.0930	1.0947	3.2777	2.5155
C3	1.3467	2.3201		3.2200	2.6407	2.6077	1.0792	1.0854
H4	2.0179	1.0867	3.2200		1.7803	1.7795	4.0461	3.5524
H5	2.0681	1.0930	2.6407	1.7803		1.7823	3.6476	2.7320
H6	2.0692	1.0947	2.6077	1.7795	1.7823		3.5931	2.3858
H7	2.0341	3.2777	1.0792	4.0461	3.6476	3.5931		1.8854
H8	2.0901	2.5155	1.0854	3.5524	2.7320	2.3858	1.8854

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.172	O1	C2	H5	110.835
O1	C2	H6	110.819	O1	C3	H7	113.497
O1	C3	H8	118.092	C2	O1	C3	114.639
H4	C2	H5	109.530	H4	C2	H6	109.329
H5	C2	H6	109.121	H7	C3	H8	121.153

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

using model chemistry: B1B95/6-311G**

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	-0.271
2	C	-0.161
3	C	-0.156
4	H	0.132
5	H	0.122
6	H	0.117
7	H	0.119
8	H	0.098

	x	y	z	Total
	-0.903	1.005	-0.316	1.388
CHELPG
AIM
ESP

	x	y	z
x	5.081	0.090	-0.016
y	0.090	3.716	-0.079
z	-0.016	-0.079	3.288

<r²>	48.157
(<r²>)^1/2	6.940

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

using model chemistry: B1B95/6-311G**

States and conformations

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