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	hartrees
Energy at 0K	-13814.981690
Energy at 298.15K
HF Energy	-13814.622062
Nuclear repulsion energy	605.859034

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3167	3002	0.01	70.34	0.08	0.15
2	A₁	1501	1423	0.27	19.75	0.68	0.81
3	A₁	499	473	1.00	13.66	0.09	0.16
4	A₁	118	112	0.01	4.33	0.41	0.58
5	A₂	1110	1052	0.00	6.38	0.75	0.86
6	B₁	3256	3086	4.55	47.69	0.75	0.86
7	B₁	756	717	9.05	2.00	0.75	0.86
8	B₂	1202	1140	98.29	0.02	0.75	0.86
9	B₂	606	575	40.85	8.38	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.100
I2	0.000	1.836	-0.094
I3	0.000	-1.836	-0.094
H4	-0.904	0.000	1.704
H5	0.904	0.000	1.704

	C1	I2	I3	H4	H5
C1		2.1901	2.1901	1.0875	1.0875
I2	2.1901		3.6714	2.7245	2.7245
I3	2.1901	3.6714		2.7245	2.7245
H4	1.0875	2.7245	2.7245		1.8082
H5	1.0875	2.7245	2.7245	1.8082

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	113.894	I2	C1	H4	107.645
I2	C1	H5	107.645	I3	C1	H4	107.645
I3	C1	H5	107.645	H4	C1	H5	112.473

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: MP2=FULL/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: MP2=FULL/3-21G*

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)