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	hartrees
Energy at 0K	-154.230908
Energy at 298.15K	-154.235822
HF Energy	-154.230908
Nuclear repulsion energy	76.428100

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3341	3341	14.16
2	A	3219	3219	12.77
3	A	3170	3170	16.44
4	A	3141	3141	41.42
5	A	3065	3065	36.13
6	A	1550	1550	13.22
7	A	1541	1541	12.00
8	A	1525	1525	4.08
9	A	1485	1485	2.45
10	A	1290	1290	153.47
11	A	1255	1255	12.00
12	A	1177	1177	1.71
13	A	1137	1137	8.52
14	A	958	958	22.97
15	A	572	572	56.17
16	A	425	425	5.51
17	A	301	301	9.15
18	A	173	173	2.90

Atom	x (Å)	y (Å)	z (Å)
O1	0.091	-0.542	-0.043
C2	-1.161	0.171	0.016
C3	1.227	0.228	0.064
H4	-1.945	-0.567	-0.139
H5	-1.283	0.648	0.993
H6	-1.206	0.933	-0.770
H7	2.141	-0.341	0.006
H8	1.175	1.272	-0.228

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4425	1.3767	2.0382	2.0923	2.0950	2.0610	2.1220
C2	1.4425		2.3895	1.0874	1.0937	1.0958	3.3422	2.5945
C3	1.3767	2.3895		3.2762	2.7094	2.6673	1.0783	1.0856
H4	2.0382	1.0874	3.2762		1.7874	1.7867	4.0951	3.6227
H5	2.0923	1.0937	2.7094	1.7874		1.7879	3.6986	2.8153
H6	2.0950	1.0958	2.6673	1.7867	1.7879		3.6650	2.4660
H7	2.0610	3.3422	1.0783	4.0951	3.6986	3.6650		1.8945
H8	2.1220	2.5945	1.0856	3.6227	2.8153	2.4660	1.8945

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	106.499	O1	C2	H5	110.412
O1	C2	H6	110.505	O1	C3	H7	113.619
O1	C3	H8	118.557	C2	O1	C3	115.874
H4	C2	H5	110.064	H4	C2	H6	109.841
H5	C2	H6	109.483	H7	C3	H8	122.209

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

using model chemistry: M06-2X/6-31G

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	-0.520
2	C	-0.189
3	C	-0.078
4	H	0.185
5	H	0.165
6	H	0.153
7	H	0.157
8	H	0.127

	x	y	z	Total
	-0.891	1.492	-0.235	1.754
CHELPG
AIM
ESP

	x	y	z
x	4.764	0.165	0.059
y	0.165	3.386	-0.103
z	0.059	-0.103	2.569

<r²>	49.624
(<r²>)^1/2	7.044

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

using model chemistry: M06-2X/6-31G

States and conformations

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