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	hartrees
Energy at 0K	-1856.187951
Energy at 298.15K	-1856.193459
Nuclear repulsion energy	169.918645

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	2990	2934	0.00
2	A₁'	1237	1214	0.00
3	A₁'	577	566	0.00
4	A₁"	47	46	0.00
5	A₂"	2989	2933	7.04
6	A₂"	1236	1213	25.27
7	A₂"	673	661	35.34
8	E'	3073	3015	14.23
8	E'	3073	3015	14.23
9	E'	1408	1381	3.82
9	E'	1407	1381	3.82
10	E'	746	732	82.52
10	E'	746	732	82.51
11	E'	127	125	0.44
11	E'	127	125	0.44
12	E"	3073	3015	0.00
12	E"	3073	3015	0.00
13	E"	1402	1376	0.00
13	E"	1402	1376	0.00
14	E"	626	614	0.00
14	E"	626	614	0.00

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.000
C2	0.000	0.000	1.864
C3	0.000	0.000	-1.864
H4	0.000	1.023	2.281
H5	0.000	1.023	-2.281
H6	-0.886	-0.511	2.281
H7	0.886	-0.511	2.281
H8	0.886	-0.511	-2.281
H9	-0.886	-0.511	-2.281

	Zn1	C2	C3	H4	H5	H6	H7	H8	H9
Zn1		1.8639	1.8639	2.4999	2.4999	2.4999	2.4999	2.4999	2.4999
C2	1.8639		3.7278	1.1045	4.2693	1.1045	1.1045	4.2693	4.2693
C3	1.8639	3.7278		4.2693	1.1045	4.2693	4.2693	1.1045	1.1045
H4	2.4999	1.1045	4.2693		4.5623	1.7713	1.7713	4.8941	4.8941
H5	2.4999	4.2693	1.1045	4.5623		4.8941	4.8941	1.7713	1.7713
H6	2.4999	1.1045	4.2693	1.7713	4.8941		1.7713	4.8941	4.5623
H7	2.4999	1.1045	4.2693	1.7713	4.8941	1.7713		4.5623	4.8941
H8	2.4999	4.2693	1.1045	4.8941	1.7713	4.8941	4.5623		1.7713
H9	2.4999	4.2693	1.1045	4.8941	1.7713	4.5623	4.8941	1.7713

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Zn1	C2	H4	112.195	Zn1	C2	H6	112.195
Zn1	C2	H7	112.195	Zn1	C3	H5	112.195
Zn1	C3	H8	112.195	Zn1	C3	H9	112.195
C2	Zn1	C3	180.000	H4	C2	H6	106.615
H4	C2	H7	106.615	H5	C3	H8	106.615
H5	C3	H9	106.615	H6	C2	H7	106.615
H8	C3	H9	106.615

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

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	0.480
2	C	-0.823
3	C	-0.823
4	H	0.194
5	H	0.194
6	H	0.194
7	H	0.194
8	H	0.194
9	H	0.194

<r²>	97.322
(<r²>)^1/2	9.865

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

using model chemistry: LSDA/6-31G*

States and conformations

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