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	hartrees
Energy at 0K	-152.329864
Energy at 298.15K	-152.334772
HF Energy	-152.329864
Nuclear repulsion energy	75.436822

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3520	3115	3.87
2	A	3469	3070	0.56
3	A	3425	3031	5.13
4	A	3325	2943	1.47
5	A	3269	2893	9.16
6	A	1659	1468	7.99
7	A	1645	1456	5.21
8	A	1614	1428	4.48
9	A	1567	1387	17.78
10	A	1329	1176	54.68
11	A	1305	1155	4.14
12	A	1177	1041	0.95
13	A	1167	1033	2.80
14	A	1024	907	1.64
15	A	776	687	21.37
16	A	468	414	2.26
17	A	340	301	6.32
18	A	171	151	1.14

Atom	x (Å)	y (Å)	z (Å)
O1	0.098	-0.596	-0.046
C2	-1.147	0.186	0.014
C3	1.208	0.258	0.096
H4	-1.974	-0.518	-0.192
H5	-1.299	0.637	1.016
H6	-1.161	0.994	-0.745
H7	2.152	-0.285	-0.060
H8	1.135	1.278	-0.316

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4710	1.4073	2.0782	2.1440	2.1454	2.0774	2.1585
C2	1.4710		2.3572	1.1052	1.1089	1.1091	3.3328	2.5509
C3	1.4073	2.3572		3.2874	2.6969	2.6195	1.0997	1.1027
H4	2.0782	1.1052	3.2874		1.8019	1.8039	4.1343	3.5922
H5	2.1440	1.1089	2.6969	1.8019		1.8016	3.7301	2.8472
H6	2.1454	1.1091	2.6195	1.8039	1.8016		3.6166	2.3528
H7	2.0774	3.3328	1.0997	4.1343	3.7301	3.6166		1.8817
H8	2.1585	2.5509	1.1027	3.5922	2.8472	2.3528	1.8817

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	106.688	O1	C2	H5	111.649
O1	C2	H6	111.747	O1	C3	H7	111.328
O1	C3	H8	118.117	C2	O1	C3	109.940
H4	C2	H5	108.939	H4	C2	H6	109.103
H5	C2	H6	108.644	H7	C3	H8	117.384

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

using model chemistry: B3PW91/STO-3G

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	-0.153
2	C	-0.133
3	C	-0.104
4	H	0.094
5	H	0.090
6	H	0.085
7	H	0.066
8	H	0.056

	x	y	z	Total
	-0.889	0.888	-0.329	1.299
CHELPG
AIM
ESP

	x	y	z
x	3.176	0.147	0.079
y	0.147	1.813	-0.033
z	0.079	-0.033	1.192

<r²>	49.103
(<r²>)^1/2	7.007

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

using model chemistry: B3PW91/STO-3G

States and conformations

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