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	hartrees
Energy at 0K	-13814.651896
Energy at 298.15K
HF Energy	-13814.487644
Nuclear repulsion energy	598.739985

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3191	2973	2.74
2	A₁	1520	1416	0.18
3	A₁	481	448	0.49
4	A₁	121	113	0.00
5	A₂	1137	1060	0.00
6	B₁	3268	3045	0.11
7	B₁	761	709	11.89
8	B₂	1233	1149	101.89
9	B₂	614	572	32.74

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.066
I2	0.000	1.866	-0.092
I3	0.000	-1.866	-0.092
H4	-0.893	0.000	1.683
H5	0.893	0.000	1.683

	C1	I2	I3	H4	H5
C1		2.1965	2.1965	1.0855	1.0855
I2	2.1965		3.7328	2.7261	2.7261
I3	2.1965	3.7328		2.7261	2.7261
H4	1.0855	2.7261	2.7261		1.7865
H5	1.0855	2.7261	2.7261	1.7865

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	116.361	I2	C1	H4	107.434
I2	C1	H5	107.434	I3	C1	H4	107.434
I3	C1	H5	107.434	H4	C1	H5	110.745

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: CID/3-21G

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: CID/3-21G

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)