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	hartrees
Energy at 0K	-1817.062378
Energy at 298.15K	-1817.065359
HF Energy	-1817.062378
Nuclear repulsion energy	75.088845

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3181	2858	52.83
2	A₁	1304	1171	15.54
3	A₁	497	446	7.58
4	E	3257	2926	28.19
4	E	3257	2926	28.19
5	E	1588	1427	3.34
5	E	1588	1427	3.34
6	E	647	582	2.27
6	E	647	582	2.27

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.496
C2	0.000	0.000	-1.523
H3	0.000	1.015	-1.911
H4	0.879	-0.508	-1.911
H5	-0.879	-0.508	-1.911

	Zn1	C2	H3	H4	H5
Zn1		2.0184	2.6123	2.6123	2.6123
C2	2.0184		1.0869	1.0869	1.0869
H3	2.6123	1.0869		1.7582	1.7582
H4	2.6123	1.0869	1.7582		1.7582
H5	2.6123	1.0869	1.7582	1.7582

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H3	110.943	Zn1	C2	H4	110.943
Zn1	C2	H5	110.943	H3	C2	H4	107.960
H3	C2	H5	107.960	H4	C2	H5	107.960

All results from a given calculation for ZnCH₃ (Zinc monomethyl)

using model chemistry: HF/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	Zn	0.368
2	C	-0.865
3	H	0.166
4	H	0.166
5	H	0.166

	x	y	z	Total
	0.000	0.000	0.194	0.194
CHELPG
AIM
ESP

<r²>	49.969
(<r²>)^1/2	7.069

All results from a given calculation for ZnCH3 (Zinc monomethyl)

using model chemistry: HF/6-31G*

States and conformations

All results from a given calculation for ZnCH₃ (Zinc monomethyl)