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	hartrees
Energy at 0K	-1810.397846
Energy at 298.15K
Nuclear repulsion energy	80.893548

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2963	2944	17.89
2	A₁	1300	1292	0.05
3	A₁	662	658	11.86
4	E	3022	3003	14.30
4	E	3022	3003	14.31
5	E	1444	1435	10.06
5	E	1444	1435	10.05
6	E	654	649	1.55
6	E	654	649	1.55

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.454
C2	0.000	0.000	-1.377
H3	0.000	1.025	-1.785
H4	0.888	-0.513	-1.785
H5	-0.888	-0.513	-1.785

	Zn1	C2	H3	H4	H5
Zn1		1.8307	2.4626	2.4626	2.4626
C2	1.8307		1.1037	1.1037	1.1037
H3	2.4626	1.1037		1.7760	1.7760
H4	2.4626	1.1037	1.7760		1.7760
H5	2.4626	1.1037	1.7760	1.7760

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H3	111.709	Zn1	C2	H4	111.709
Zn1	C2	H5	111.709	H3	C2	H4	107.144
H3	C2	H5	107.144	H4	C2	H5	107.144

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

using model chemistry: BLYP/3-21G*

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	0.286
2	C	-0.935
3	H	0.216
4	H	0.216
5	H	0.216

	x	y	z	Total
	0.000	0.000	-0.677	0.677
CHELPG
AIM
ESP

	x	y	z
x	7.240	0.000	0.000
y	0.000	7.243	-0.001
z	0.000	-0.001	8.306

<r²>	44.773
(<r²>)^1/2	6.691

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

using model chemistry: BLYP/3-21G*

States and conformations

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