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	hartrees
Energy at 0K	-1816.435909
Energy at 298.15K
Nuclear repulsion energy	78.950150

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2991	2935	2.39
2	A₁	1157	1136	0.01
3	A₁	579	568	12.73
4	E	3095	3038	3.14
4	E	3095	3038	3.14
5	E	1363	1338	7.71
5	E	1363	1338	7.70
6	E	605	594	2.21
6	E	605	594	2.20

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.466
C2	0.000	0.000	-1.424
H3	0.000	1.030	-1.816
H4	0.892	-0.515	-1.816
H5	-0.892	-0.515	-1.816

	Zn1	C2	H3	H4	H5
Zn1		1.8899	2.5040	2.5040	2.5040
C2	1.8899		1.1025	1.1025	1.1025
H3	2.5040	1.1025		1.7846	1.7846
H4	2.5040	1.1025	1.7846		1.7846
H5	2.5040	1.1025	1.7846	1.7846

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H3	110.841	Zn1	C2	H4	110.841
Zn1	C2	H5	110.841	H3	C2	H4	108.068
H3	C2	H5	108.068	H4	C2	H5	108.068

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

using model chemistry: LSDA/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	0.226
2	C	-0.713
3	H	0.162
4	H	0.162
5	H	0.162

	x	y	z	Total
	0.000	0.000	-0.686	0.686
CHELPG
AIM
ESP

	x	y	z
x	6.951	0.000	0.000
y	0.000	6.954	-0.001
z	0.000	-0.001	8.431

<r²>	45.830
(<r²>)^1/2	6.770

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

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

States and conformations

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