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	hartrees
Energy at 0K	-115.009520
Energy at 298.15K	-115.012416
Nuclear repulsion energy	34.378986

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3033	2906	47.87
2	A	2995	2870	39.24
3	A	2924	2802	0.81
4	A	1531	1468	5.29
5	A	1380	1323	13.53
6	A	1376	1318	18.30
7	A	1142	1095	8.31
8	A	971	930	1.05
9	A	844	809	57.10

Atom	x (Å)	y (Å)	z (Å)
C1	-0.572	0.000	-0.013
O2	0.791	0.000	-0.008
H3	-0.869	-0.002	1.055
H4	-1.015	0.909	-0.453
H5	-1.015	-0.908	-0.456

	C1	O2	H3	H4	H5
C1		1.3632	1.1094	1.1029	1.1029
O2	1.3632		1.9717	2.0705	2.0705
H3	1.1094	1.9717		1.7684	1.7682
H4	1.1029	2.0705	1.7684		1.8172
H5	1.1029	2.0705	1.7682	1.8172

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	C1	H3	105.313	O2	C1	H4	113.781
O2	C1	H5	113.772	H3	C1	H4	106.138
H3	C1	H5	106.119	H4	C1	H5	110.942

All results from a given calculation for CH₃O (Methoxy radical)

using model chemistry: B3PW91/6-31G**

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	C	-0.134
2	O	-0.301
3	H	0.171
4	H	0.132
5	H	0.132

	x	y	z	Total
	-1.990	-0.001	0.245	2.005
CHELPG
AIM
ESP

<r²>	20.678
(<r²>)^1/2	4.547

All results from a given calculation for CH3O (Methoxy radical)

using model chemistry: B3PW91/6-31G**

States and conformations

All results from a given calculation for CH₃O (Methoxy radical)