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	hartrees
Energy at 0K	-499.216099
Energy at 298.15K	-499.219004
HF Energy	-499.055343
Nuclear repulsion energy	49.045903

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3084	2971	15.74
2	A₁	1407	1356	17.02
3	A₁	632	609	23.33
4	E	3201	3084	7.52
4	E	3201	3084	7.52
5	E	1522	1466	7.13
5	E	1522	1466	7.13
6	E	1025	988	3.87
6	E	1025	988	3.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.204
Cl2	0.000	0.000	0.694
H3	0.000	1.046	-1.524
H4	0.906	-0.523	-1.524
H5	-0.906	-0.523	-1.524

	C1	Cl2	H3	H4	H5
C1		1.8972	1.0935	1.0935	1.0935
Cl2	1.8972		2.4515	2.4515	2.4515
H3	1.0935	2.4515		1.8111	1.8111
H4	1.0935	2.4515	1.8111		1.8111
H5	1.0935	2.4515	1.8111	1.8111

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	107.017	Cl2	C1	H4	107.017
Cl2	C1	H5	107.017	H3	C1	H4	111.810
H3	C1	H5	111.810	H4	C1	H5	111.810

All results from a given calculation for CH₃Cl (Methyl chloride)

using model chemistry: QCISD/6-31G

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 CH3Cl (Methyl chloride)

using model chemistry: QCISD/6-31G

States and conformations

All results from a given calculation for CH₃Cl (Methyl chloride)