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	hartrees
Energy at 0K	-1859.155746
Energy at 298.15K	-1859.161354
Nuclear repulsion energy	164.899056

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3026	2924	0.00
2	A₁'	1276	1233	0.00
3	A₁'	519	501	0.00
4	A₁"	20	19	0.00
5	A₂"	3024	2922	81.45
6	A₂"	1278	1235	9.14
7	A₂"	617	597	35.49
8	E'	3091	2987	61.91
8	E'	3091	2987	61.92
9	E'	1484	1434	8.12
9	E'	1484	1434	8.12
10	E'	761	735	78.48
10	E'	761	735	78.48
11	E'	160	154	6.12
11	E'	160	154	6.12
12	E"	3090	2986	0.00
12	E"	3090	2986	0.00
13	E"	1480	1431	0.00
13	E"	1480	1431	0.00
14	E"	691	668	0.00
14	E"	691	668	0.00

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.000
C2	0.000	0.000	1.939
C3	0.000	0.000	-1.939
H4	0.000	1.015	2.347
H5	0.000	1.015	-2.347
H6	-0.879	-0.508	2.347
H7	0.879	-0.508	2.347
H8	0.879	-0.508	-2.347
H9	-0.879	-0.508	-2.347

	Zn1	C2	C3	H4	H5	H6	H7	H8	H9
Zn1		1.9394	1.9394	2.5573	2.5573	2.5573	2.5573	2.5573	2.5573
C2	1.9394		3.8788	1.0941	4.4051	1.0941	1.0941	4.4051	4.4051
C3	1.9394	3.8788		4.4051	1.0941	4.4051	4.4051	1.0941	1.0941
H4	2.5573	1.0941	4.4051		4.6943	1.7586	1.7586	5.0129	5.0129
H5	2.5573	4.4051	1.0941	4.6943		5.0129	5.0129	1.7586	1.7586
H6	2.5573	1.0941	4.4051	1.7586	5.0129		1.7586	5.0129	4.6943
H7	2.5573	1.0941	4.4051	1.7586	5.0129	1.7586		4.6943	5.0129
H8	2.5573	4.4051	1.0941	5.0129	1.7586	5.0129	4.6943		1.7586
H9	2.5573	4.4051	1.0941	5.0129	1.7586	4.6943	5.0129	1.7586

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H4	111.879	Zn1	C2	H6	111.879
Zn1	C2	H7	111.879	Zn1	C3	H5	111.879
Zn1	C3	H8	111.879	Zn1	C3	H9	111.879
C2	Zn1	C3	180.000	H4	C2	H6	106.960
H4	C2	H7	106.960	H5	C3	H8	106.960
H5	C3	H9	106.960	H6	C2	H7	106.960
H8	C3	H9	106.960

All results from a given calculation for Zn(CH₃)₂ (dimethyl zinc)

using model chemistry: B3LYP/6-311G*

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	1.080
2	C	-1.214
3	C	-1.214
4	H	0.225
5	H	0.225
6	H	0.225
7	H	0.225
8	H	0.225
9	H	0.225

<r²>	103.527
(<r²>)^1/2	10.175

All results from a given calculation for Zn(CH3)2 (dimethyl zinc)

using model chemistry: B3LYP/6-311G*

States and conformations

All results from a given calculation for Zn(CH₃)₂ (dimethyl zinc)