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	hartrees
Energy at 0K	-436.072259
Energy at 298.15K
HF Energy	-435.174974
Nuclear repulsion energy	120.218633

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3144	3144	10.73
2	A'	1522	1522	0.56
3	A'	1340	1340	65.48
4	A'	1129	1129	193.29
5	A'	606	606	33.04
6	A'	280	280	0.89
7	A"	3227	3227	2.31
8	A"	1279	1279	2.97
9	A"	890	890	0.52

Atom	x (Å)	y (Å)	z (Å)
C1	0.522	-1.457	0.000
F2	-0.591	-2.235	0.000
I3	0.000	0.607	0.000
H4	1.096	-1.643	0.899
H5	1.096	-1.643	-0.899

	C1	F2	I3	H4	H5
C1		1.3579	2.1287	1.0829	1.0829
F2	1.3579		2.9028	2.0016	2.0016
I3	2.1287	2.9028		2.6586	2.6586
H4	1.0829	2.0016	2.6586		1.7982
H5	1.0829	2.0016	2.6586	1.7982

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	I3	110.782	F2	C1	H4	109.667
F2	C1	H5	109.667	I3	C1	H4	107.215
I3	C1	H5	107.215	H4	C1	H5	112.254

All results from a given calculation for CH₂FI (fluoroiodomethane)

using model chemistry: CCD/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 CH2FI (fluoroiodomethane)

using model chemistry: CCD/Def2TZVPP

States and conformations

All results from a given calculation for CH₂FI (fluoroiodomethane)