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	hartrees
Energy at 0K	-13873.219775
Energy at 298.15K
HF Energy	-13872.653882
Nuclear repulsion energy	611.327288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3153	3011	0.77
2	A₁	1460	1395	0.00
3	A₁	495	473	0.23
4	A₁	122	117	0.03
5	A₂	1117	1067	0.00
6	B₁	3235	3090	2.04
7	B₁	752	718	10.38
8	B₂	1213	1158	97.43
9	B₂	606	578	26.35

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.053
I2	0.000	1.825	-0.091
I3	0.000	-1.825	-0.091
H4	-0.894	0.000	1.670
H5	0.894	0.000	1.670

	C1	I2	I3	H4	H5
C1		2.1539	2.1539	1.0863	1.0863
I2	2.1539		3.6503	2.6890	2.6890
I3	2.1539	3.6503		2.6890	2.6890
H4	1.0863	2.6890	2.6890		1.7885
H5	1.0863	2.6890	2.6890	1.7885

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.850	I2	C1	H4	107.548
I2	C1	H5	107.548	I3	C1	H4	107.548
I3	C1	H5	107.548	H4	C1	H5	110.807

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: CCD/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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All results from a given calculation for CH2I2 (Diiodomethane)

using model chemistry: CCD/6-311G*

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)