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	hartrees
Energy at 0K	-1858.979989
Energy at 298.15K	-1858.985336
Nuclear repulsion energy	163.096348

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	2956	2940	0.00
2	A₁'	1178	1172	0.00
3	A₁'	474	472	0.00
4	A₁"	11	11	0.00
5	A₂"	2953	2938	58.32
6	A₂"	1181	1175	1.49
7	A₂"	577	574	43.33
8	E'	3032	3016	34.11
8	E'	3032	3016	34.11
9	E'	1432	1425	3.46
9	E'	1432	1425	3.46
10	E'	720	717	39.24
10	E'	720	717	39.24
11	E'	139	139	1.01
11	E'	139	139	1.01
12	E"	3032	3016	0.00
12	E"	3032	3016	0.00
13	E"	1427	1420	0.00
13	E"	1427	1420	0.00
14	E"	629	626	0.00
14	E"	629	626	0.00

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.000
C2	0.000	0.000	1.965
C3	0.000	0.000	-1.965
H4	0.000	1.031	2.357
H5	0.000	1.031	-2.357
H6	-0.893	-0.516	2.357
H7	0.893	-0.516	2.357
H8	0.893	-0.516	-2.357
H9	-0.893	-0.516	-2.357

	Zn1	C2	C3	H4	H5	H6	H7	H8	H9
Zn1		1.9655	1.9655	2.5729	2.5729	2.5729	2.5729	2.5729	2.5729
C2	1.9655		3.9310	1.1030	4.4440	1.1030	1.1030	4.4440	4.4440
C3	1.9655	3.9310		4.4440	1.1030	4.4440	4.4440	1.1030	1.1030
H4	2.5729	1.1030	4.4440		4.7145	1.7858	1.7858	5.0413	5.0413
H5	2.5729	4.4440	1.1030	4.7145		5.0413	5.0413	1.7858	1.7858
H6	2.5729	1.1030	4.4440	1.7858	5.0413		1.7858	5.0413	4.7145
H7	2.5729	1.1030	4.4440	1.7858	5.0413	1.7858		4.7145	5.0413
H8	2.5729	4.4440	1.1030	5.0413	1.7858	5.0413	4.7145		1.7858
H9	2.5729	4.4440	1.1030	5.0413	1.7858	4.7145	5.0413	1.7858

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H4	110.804	Zn1	C2	H6	110.804
Zn1	C2	H7	110.804	Zn1	C3	H5	110.804
Zn1	C3	H8	110.804	Zn1	C3	H9	110.804
C2	Zn1	C3	180.000	H4	C2	H6	108.106
H4	C2	H7	108.106	H5	C3	H8	108.106
H5	C3	H9	108.106	H6	C2	H7	108.106
H8	C3	H9	108.106

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

using model chemistry: BLYP/6-31+G**

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	0.107
2	C	-0.481
3	C	-0.481
4	H	0.143
5	H	0.143
6	H	0.143
7	H	0.143
8	H	0.143
9	H	0.143

<r²>	105.241
(<r²>)^1/2	10.259

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

using model chemistry: BLYP/6-31+G**

States and conformations

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