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	hartrees
Energy at 0K	-115.074141
Energy at 298.15K	-115.076596
HF Energy	-115.074141
Nuclear repulsion energy	34.973887

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3678	3666	38.80
2	A	3187	3177	17.10
3	A	3048	3038	20.73
4	A	1442	1437	5.55
5	A	1331	1327	29.66
6	A	1146	1142	74.81
7	A	1026	1023	48.25
8	A	541	540	101.55
9	A	423	421	39.49

Atom	x (Å)	y (Å)	z (Å)
C1	0.692	0.027	-0.064
O2	-0.678	-0.127	0.021
H3	1.239	-0.894	0.106
H4	1.130	0.997	0.166
H5	-1.099	0.746	-0.053

	C1	O2	H3	H4	H5
C1		1.3809	1.0843	1.0880	1.9298
O2	1.3809		2.0658	2.1333	0.9721
H3	1.0843	2.0658		1.8941	2.8598
H4	1.0880	2.1333	1.8941		2.2536
H5	1.9298	0.9721	2.8598	2.2536

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	O2	H5	108.966		O2	C1	H3	113.309
O2	C1	H4	119.071		H3	C1	H4	121.368

All results from a given calculation for CH₂OH (Hydroxymethyl radical)

using model chemistry: BLYP/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	C	-0.135
2	O	-0.234
3	H	0.097
4	H	0.065
5	H	0.207

	x	y	z	Total
	-0.145	1.422	0.251	1.451
CHELPG
AIM
ESP

	x	y	z
x	3.243	-0.126	0.034
y	-0.126	2.715	0.006
z	0.034	0.006	2.008

<r²>	20.897
(<r²>)^1/2	4.571

All results from a given calculation for CH2OH (Hydroxymethyl radical)

using model chemistry: BLYP/cc-pVTZ

States and conformations

All results from a given calculation for CH₂OH (Hydroxymethyl radical)