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	hartrees
Energy at 0K	-153.456570
Energy at 298.15K	-153.461683
HF Energy	-153.456570
Nuclear repulsion energy	78.073710

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3376	3057	28.52
2	A	3271	2962	37.61
3	A	3236	2930	31.38
4	A	3212	2909	64.01
5	A	3152	2854	51.33
6	A	1630	1476	1.51
7	A	1628	1474	10.01
8	A	1617	1464	4.18
9	A	1582	1432	11.80
10	A	1391	1260	159.68
11	A	1368	1239	86.81
12	A	1285	1164	3.76
13	A	1229	1113	15.26
14	A	1060	959	30.45
15	A	833	754	20.99
16	A	454	411	3.90
17	A	281	254	10.32
18	A	183	165	1.53

Atom	x (Å)	y (Å)	z (Å)
O1	0.085	-0.527	-0.056
C2	-1.126	0.165	0.020
C3	1.194	0.222	0.086
H4	-1.919	-0.551	-0.151
H5	-1.259	0.619	0.998
H6	-1.181	0.943	-0.739
H7	2.103	-0.345	0.003
H8	1.167	1.230	-0.302

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.3959	1.3462	2.0060	2.0564	2.0561	2.0276	2.0784
C2	1.3959		2.3213	1.0818	1.0867	1.0882	3.2687	2.5489
C3	1.3462	2.3213		3.2163	2.6475	2.6149	1.0745	1.0800
H4	2.0060	1.0818	3.2163		1.7673	1.7666	4.0304	3.5664
H5	2.0564	1.0867	2.6475	1.7673		1.7688	3.6365	2.8202
H6	2.0561	1.0882	2.6149	1.7666	1.7688		3.6042	2.4055
H7	2.0276	3.2687	1.0745	4.0304	3.6365	3.6042		1.8568
H8	2.0784	2.5489	1.0800	3.5664	2.8202	2.4055	1.8568

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.440	O1	C2	H5	111.245
O1	C2	H6	111.120	O1	C3	H7	113.303
O1	C3	H8	117.470	C2	O1	C3	115.666
H4	C2	H5	109.169	H4	C2	H6	108.991
H5	C2	H6	108.827	H7	C3	H8	119.043

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

using model chemistry: HF/6-31G(2df,p)

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	-0.368
2	C	-0.171
3	C	-0.145
4	H	0.152
5	H	0.132
6	H	0.126
7	H	0.148
8	H	0.125

	x	y	z	Total
	-0.558	1.120	-0.212	1.269
CHELPG
AIM
ESP

	x	y	z
x	4.477	0.044	0.002
y	0.044	3.480	-0.125
z	0.002	-0.125	2.943

<r²>	47.910
(<r²>)^1/2	6.922

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

using model chemistry: HF/6-31G(2df,p)

States and conformations

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