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	hartrees
Energy at 0K	-154.235633
Energy at 298.15K	-154.240588
HF Energy	-154.235633
Nuclear repulsion energy	77.640716

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3274	3144	15.17
2	A	3157	3032	20.38
3	A	3119	2995	23.53
4	A	3079	2957	53.37
5	A	3014	2895	54.83
6	A	1503	1443	17.16
7	A	1496	1437	5.23
8	A	1483	1424	9.44
9	A	1455	1398	1.77
10	A	1313	1261	149.30
11	A	1260	1210	19.30
12	A	1173	1127	1.48
13	A	1142	1097	5.58
14	A	994	955	33.26
15	A	593	570	47.51
16	A	432	415	3.68
17	A	299	287	6.69
18	A	177	170	1.95

Atom	x (Å)	y (Å)	z (Å)
O1	0.090	-0.542	-0.041
C2	-1.128	0.168	0.014
C3	1.193	0.227	0.070
H4	-1.929	-0.558	-0.124
H5	-1.249	0.664	0.984
H6	-1.180	0.920	-0.783
H7	2.118	-0.327	-0.022
H8	1.129	1.269	-0.233

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4107	1.3494	2.0208	2.0731	2.0742	2.0390	2.0968
C2	1.4107		2.3228	1.0895	1.0960	1.0977	3.2833	2.5234
C3	1.3494	2.3228		3.2253	2.6443	2.6157	1.0815	1.0876
H4	2.0208	1.0895	3.2253		1.7841	1.7832	4.0544	3.5636
H5	2.0731	1.0960	2.6443	1.7841		1.7867	3.6509	2.7390
H6	2.0742	1.0977	2.6157	1.7832	1.7867		3.6072	2.3988
H7	2.0390	3.2833	1.0815	4.0544	3.6509	3.6072		1.8901
H8	2.0968	2.5234	1.0876	3.5636	2.7390	2.3988	1.8901

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.148	O1	C2	H5	110.968
O1	C2	H6	110.947	O1	C3	H7	113.566
O1	C3	H8	118.326	C2	O1	C3	114.596
H4	C2	H5	109.435	H4	C2	H6	109.230
H5	C2	H6	109.074	H7	C3	H8	121.233

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

using model chemistry: HSEh1PBE/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	-0.274
2	C	-0.160
3	C	-0.154
4	H	0.132
5	H	0.120
6	H	0.116
7	H	0.121
8	H	0.099

	x	y	z	Total
	-0.841	1.020	-0.297	1.355
CHELPG
AIM
ESP

	x	y	z
x	5.075	0.086	-0.015
y	0.086	3.727	-0.081
z	-0.015	-0.081	3.299

<r²>	48.312
(<r²>)^1/2	6.951

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

using model chemistry: HSEh1PBE/6-311G**

States and conformations

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