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	hartrees
Energy at 0K	-1856.699457
Energy at 298.15K	-1856.704924
HF Energy	-1856.699457
Nuclear repulsion energy	162.803554

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3175	2853	0.00
2	A₁'	1382	1241	0.00
3	A₁'	511	460	0.00
4	A₁"	31	28	0.00
5	A₂"	3172	2850	67.42
6	A₂"	1376	1236	4.66
7	A₂"	614	551	41.80
8	E'	3235	2907	70.23
8	E'	3235	2907	70.23
9	E'	1599	1437	0.48
9	E'	1599	1437	0.48
10	E'	757	680	104.03
10	E'	757	680	104.03
11	E'	119	107	8.07
11	E'	119	107	8.07
12	E"	3235	2906	0.00
12	E"	3235	2906	0.00
13	E"	1597	1435	0.00
13	E"	1597	1435	0.00
14	E"	661	594	0.00
14	E"	661	594	0.00

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.000
C2	0.000	0.000	1.972
C3	0.000	0.000	-1.972
H4	0.000	1.009	2.380
H5	0.000	1.009	-2.380
H6	-0.874	-0.505	2.380
H7	0.874	-0.505	2.380
H8	0.874	-0.505	-2.380
H9	-0.874	-0.505	-2.380

	Zn1	C2	C3	H4	H5	H6	H7	H8	H9
Zn1		1.9725	1.9725	2.5851	2.5851	2.5851	2.5851	2.5851	2.5851
C2	1.9725		3.9449	1.0882	4.4679	1.0882	1.0882	4.4679	4.4679
C3	1.9725	3.9449		4.4679	1.0882	4.4679	4.4679	1.0882	1.0882
H4	2.5851	1.0882	4.4679		4.7601	1.7477	1.7477	5.0708	5.0708
H5	2.5851	4.4679	1.0882	4.7601		5.0708	5.0708	1.7477	1.7477
H6	2.5851	1.0882	4.4679	1.7477	5.0708		1.7477	5.0708	4.7601
H7	2.5851	1.0882	4.4679	1.7477	5.0708	1.7477		4.7601	5.0708
H8	2.5851	4.4679	1.0882	5.0708	1.7477	5.0708	4.7601		1.7477
H9	2.5851	4.4679	1.0882	5.0708	1.7477	4.7601	5.0708	1.7477

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H4	111.996	Zn1	C2	H6	111.996
Zn1	C2	H7	111.996	Zn1	C3	H5	111.996
Zn1	C3	H8	111.996	Zn1	C3	H9	111.996
C2	Zn1	C3	180.000	H4	C2	H6	106.833
H4	C2	H7	106.833	H5	C3	H8	106.833
H5	C3	H9	106.833	H6	C2	H7	106.833
H8	C3	H9	106.833

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

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	0.774
2	C	-0.880
3	C	-0.880
4	H	0.164
5	H	0.164
6	H	0.164
7	H	0.164
8	H	0.164
9	H	0.164

<r²>	105.745
(<r²>)^1/2	10.283

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

using model chemistry: HF/6-31G*

States and conformations

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