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	hartrees
Energy at 0K	-114.465111
Energy at 298.15K	-114.468041
HF Energy	-114.465111
Nuclear repulsion energy	34.327679

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3225	2930	49.25
2	A	3205	2912	41.43
3	A	3142	2855	15.61
4	A	1640	1490	6.01
5	A	1558	1415	5.46
6	A	1556	1413	11.40
7	A	1197	1088	22.18
8	A	1091	991	17.17
9	A	805	732	56.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.585	0.000	-0.006
O2	0.796	0.000	-0.006
H3	-0.888	-0.004	1.039
H4	-0.985	0.894	-0.474
H5	-0.984	-0.891	-0.481

	C1	O2	H3	H4	H5
C1		1.3814	1.0881	1.0851	1.0852
O2	1.3814		1.9817	2.0467	2.0465
H3	1.0881	1.9817		1.7622	1.7620
H4	1.0851	2.0467	1.7622		1.7847
H5	1.0852	2.0465	1.7620	1.7847

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	C1	H3	106.130	O2	C1	H4	111.591
O2	C1	H5	111.568	H3	C1	H4	108.367
H3	C1	H5	108.345	H4	C1	H5	110.636

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

using model chemistry: HF/TZVP

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	-0.069
2	O	-0.199
3	H	0.102
4	H	0.083
5	H	0.083

	x	y	z	Total
	-2.046	-0.001	0.117	2.049
CHELPG
AIM
ESP

	x	y	z
x	2.385	-0.000	0.027
y	-0.000	2.418	0.002
z	0.027	0.002	2.122

<r²>	20.872
(<r²>)^1/2	4.569

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

using model chemistry: HF/TZVP

States and conformations

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