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	hartrees
Energy at 0K	-153.610406
Energy at 298.15K	-153.615165
HF Energy	-153.610406
Nuclear repulsion energy	78.030388

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3207	3172	3.89
2	A	3072	3039	7.77
3	A	3052	3019	12.01
4	A	2976	2943	39.47
5	A	2918	2886	52.91
6	A	1440	1425	27.76
7	A	1421	1406	8.94
8	A	1403	1387	13.86
9	A	1383	1368	1.26
10	A	1316	1302	94.73
11	A	1206	1193	14.04
12	A	1123	1111	1.15
13	A	1098	1086	4.05
14	A	996	985	30.60
15	A	430	425	5.99
16	A	413	408	63.52
17	A	292	288	3.61
18	A	161	159	3.28

Atom	x (Å)	y (Å)	z (Å)
O1	0.090	-0.543	-0.026
C2	-1.116	0.165	0.008
C3	1.182	0.223	0.049
H4	-1.933	-0.560	-0.094
H5	-1.223	0.709	0.963
H6	-1.165	0.893	-0.822
H7	2.123	-0.315	-0.031
H8	1.088	1.293	-0.153

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.3990	1.3361	2.0241	2.0665	2.0667	2.0458	2.0939
C2	1.3990		2.2992	1.0962	1.1043	1.1055	3.2749	2.4816
C3	1.3361	2.2992		3.2148	2.6181	2.5916	1.0872	1.0931
H4	2.0241	1.0962	3.2148		1.7976	1.7967	4.0638	3.5442
H5	2.0665	1.1043	2.6181	1.7976		1.7956	3.6377	2.6318
H6	2.0667	1.1055	2.5916	1.7967	1.7956		3.5913	2.3842
H7	2.0458	3.2749	1.0872	4.0638	3.6377	3.5913		1.9167
H8	2.0939	2.4816	1.0931	3.5442	2.6318	2.3842	1.9167

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.807	O1	C2	H5	110.729
O1	C2	H6	110.668	O1	C3	H7	114.788
O1	C3	H8	118.742	C2	O1	C3	114.397
H4	C2	H5	109.552	H4	C2	H6	109.378
H5	C2	H6	108.690	H7	C3	H8	123.064

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

using model chemistry: LSDA/cc-pVTZ

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	-0.123
2	C	-0.146
3	C	-0.212
4	H	0.119
5	H	0.087
6	H	0.082
7	H	0.118
8	H	0.077

	x	y	z	Total
	-0.958	0.815	-0.253	1.284
CHELPG
AIM
ESP

	x	y	z
x	5.829	0.003	-0.034
y	0.003	4.265	-0.055
z	-0.034	-0.055	4.005

<r²>	48.129
(<r²>)^1/2	6.938

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

using model chemistry: LSDA/cc-pVTZ

States and conformations

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