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	hartrees
Energy at 0K	-153.613934
Energy at 298.15K	-153.618601
HF Energy	-153.613934
Nuclear repulsion energy	78.018914

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3214	3184	2.22
2	A	3074	3045	6.46
3	A	3060	3031	12.49
4	A	2980	2952	38.66
5	A	2922	2894	54.55
6	A	1439	1426	34.33
7	A	1417	1404	8.53
8	A	1405	1391	15.48
9	A	1382	1369	1.26
10	A	1312	1300	111.03
11	A	1203	1192	13.43
12	A	1120	1109	1.21
13	A	1095	1084	3.94
14	A	991	982	31.43
15	A	429	425	3.23
16	A	375	371	61.65
17	A	274	271	13.92
18	A	142	141	6.38

Atom	x (Å)	y (Å)	z (Å)
O1	0.091	-0.543	-0.022
C2	-1.118	0.165	0.007
C3	1.182	0.222	0.040
H4	-1.933	-0.562	-0.093
H5	-1.224	0.711	0.961
H6	-1.164	0.889	-0.826
H7	2.126	-0.314	-0.022
H8	1.087	1.297	-0.128

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4010	1.3345	2.0244	2.0654	2.0662	2.0479	2.0947
C2	1.4010		2.3017	1.0960	1.1040	1.1049	3.2793	2.4824
C3	1.3345	2.3017		3.2149	2.6226	2.5889	1.0868	1.0924
H4	2.0244	1.0960	3.2149		1.7982	1.7976	4.0663	3.5458
H5	2.0654	1.1040	2.6226	1.7982		1.7971	3.6385	2.6211
H6	2.0662	1.1049	2.5889	1.7976	1.7971		3.5939	2.3917
H7	2.0479	3.2793	1.0868	4.0663	3.6385	3.5939		1.9201
H8	2.0947	2.4824	1.0924	3.5458	2.6211	2.3917	1.9201

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	H4	107.710	O1	C2	H5	110.527
O1	C2	H6	110.529	O1	C3	H7	115.130
O1	C3	H8	119.003	C2	O1	C3	114.563
H4	C2	H5	109.645	H4	C2	H6	109.520
H5	C2	H6	108.894	H7	C3	H8	123.558

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

using model chemistry: LSDA/aug-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	-0.245
2	C	-0.448
3	C	-0.674
4	H	0.251
5	H	0.232
6	H	0.240
7	H	0.339
8	H	0.306

	x	y	z	Total
	-1.043	0.779	-0.230	1.322
CHELPG
AIM
ESP

	x	y	z
x	6.594	0.017	-0.015
y	0.017	4.963	-0.003
z	-0.015	-0.003	5.433

<r²>	48.377
(<r²>)^1/2	6.955

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

using model chemistry: LSDA/aug-cc-pVTZ

States and conformations

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