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	hartrees
Energy at 0K	-599.362071
Energy at 298.15K	-599.364708
Nuclear repulsion energy	100.312787

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3075	2983	26.08
2	A'	1477	1433	1.09
3	A'	1348	1308	43.59
4	A'	1100	1067	175.24
5	A'	726	704	99.79
6	A'	376	365	1.20
7	A"	3157	3062	15.09
8	A"	1236	1199	3.41
9	A"	987	957	0.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.816	0.000
F2	1.361	0.779	0.000
Cl3	-0.678	-0.854	0.000
H4	-0.359	1.310	0.913
H5	-0.359	1.310	-0.913

	C1	F2	Cl3	H4	H5
C1		1.3612	1.8025	1.0987	1.0987
F2	1.3612		2.6121	2.0184	2.0184
Cl3	1.8025	2.6121		2.3707	2.3707
H4	1.0987	2.0184	2.3707		1.8262
H5	1.0987	2.0184	2.3707	1.8262

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	Cl3	110.535	F2	C1	H4	109.812
F2	C1	H5	109.812	Cl3	C1	H4	107.099
Cl3	C1	H5	107.099	H4	C1	H5	112.421

All results from a given calculation for CH₂FCl (fluorochloromethane)

using model chemistry: B3LYP/cc-pVDZ

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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Number	Element	Mulliken
1	C	0.190
2	F	-0.193
3	Cl	-0.137
4	H	0.070
5	H	0.070

	x	y	z	Total
	-0.859	1.641	0.000	1.852
CHELPG
AIM
ESP

	x	y	z
x	2.888	0.757	0.000
y	0.757	4.073	0.000
z	0.000	0.000	2.419

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2FCl (fluorochloromethane)

using model chemistry: B3LYP/cc-pVDZ

States and conformations

All results from a given calculation for CH₂FCl (fluorochloromethane)