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	hartrees
Energy at 0K	-433.854758
Energy at 298.15K
HF Energy	-433.169687
Nuclear repulsion energy	120.158252

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3160	3160	10.00	106.33	0.08	0.15
2	A'	1522	1522	0.15	6.96	0.72	0.84
3	A'	1329	1329	60.11	3.25	0.11	0.20
4	A'	1110	1110	189.77	3.22	0.60	0.75
5	A'	607	607	36.36	21.77	0.21	0.35
6	A'	279	279	0.57	4.43	0.36	0.53
7	A"	3231	3231	1.49	52.74	0.75	0.86
8	A"	1272	1272	2.47	3.02	0.75	0.86
9	A"	887	887	0.55	1.18	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.521	-1.458	0.000
F2	-0.591	-2.239	0.000
I3	0.000	0.607	0.000
H4	1.095	-1.637	0.897
H5	1.095	-1.637	-0.897

	C1	F2	I3	H4	H5
C1		1.3585	2.1303	1.0796	1.0796
F2	1.3585		2.9073	2.0018	2.0018
I3	2.1303	2.9073		2.6530	2.6530
H4	1.0796	2.0018	2.6530		1.7941
H5	1.0796	2.0018	2.6530	1.7941

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	I3	110.941	F2	C1	H4	109.854
F2	C1	H5	109.854	I3	C1	H4	106.871
I3	C1	H5	106.871	H4	C1	H5	112.386

All results from a given calculation for CH₂FI (fluoroiodomethane)

using model chemistry: MP2=FULL/cc-pVTZ-PP

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 CH2FI (fluoroiodomethane)

using model chemistry: MP2=FULL/cc-pVTZ-PP

States and conformations

All results from a given calculation for CH₂FI (fluoroiodomethane)