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	hartrees
Energy at 0K	-633.701658
Energy at 298.15K
HF Energy	-632.356434
Nuclear repulsion energy	193.372959

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3141	3141
2	A₁	1417	1417
3	A₁	502	502
4	A₁	119	119
5	A₂	1062	1062
6	B₁	3227	3227
7	B₁	721	721
8	B₂	1138	1138
9	B₂	614	614

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.049
I2	0.000	1.789	-0.091
I3	0.000	-1.789	-0.091
H4	-0.893	0.000	1.656
H5	0.893	0.000	1.656

	C1	I2	I3	H4	H5
C1		2.1213	2.1213	1.0797	1.0797
I2	2.1213		3.5784	2.6550	2.6550
I3	2.1213	3.5784		2.6550	2.6550
H4	1.0797	2.6550	2.6550		1.7859
H5	1.0797	2.6550	2.6550	1.7859

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.015	I2	C1	H4	107.577
I2	C1	H5	107.577	I3	C1	H4	107.577
I3	C1	H5	107.577	H4	C1	H5	111.588

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: QCISD(T)=FULL/Def2TZVPP

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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All results from a given calculation for CH2I2 (Diiodomethane)

using model chemistry: QCISD(T)=FULL/Def2TZVPP

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)