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	hartrees
Energy at 0K	-6987.367163
Energy at 298.15K
HF Energy	-6987.283775
Nuclear repulsion energy	213.116781

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'	3332	2962	6.00	39.06	0.14	0.25
2	A'	1691	1503	1.68	14.31	0.73	0.85
3	A'	1452	1291	96.21	2.54	0.74	0.85
4	A'	1244	1106	38.34	6.12	0.72	0.84
5	A'	662	588	25.87	20.34	0.33	0.49
6	A'	304	271	1.53	4.57	0.54	0.70
7	A"	3445	3063	5.90	33.55	0.75	0.86
8	A"	1347	1197	3.45	10.64	0.75	0.86
9	A"	961	854	2.00	4.16	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.517	-1.484	0.000
F2	-0.599	-2.320	0.000
I3	0.000	0.625	0.000
H4	1.143	-1.677	0.905
H5	1.143	-1.677	-0.905

	C1	F2	I3	H4	H5
C1		1.3944	2.1718	1.1172	1.1172
F2	1.3944		3.0060	2.0656	2.0656
I3	2.1718	3.0060		2.7253	2.7253
H4	1.1172	2.0656	2.7253		1.8098
H5	1.1172	2.0656	2.7253	1.8098

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	I3	113.084	F2	C1	H4	110.162
F2	C1	H5	110.162	I3	C1	H4	107.539
I3	C1	H5	107.539	H4	C1	H5	108.188

All results from a given calculation for CH₂FI (fluoroiodomethane)

using model chemistry: MP2=FULL/STO-3G

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/STO-3G

States and conformations

All results from a given calculation for CH₂FI (fluoroiodomethane)