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	hartrees
Energy at 0K	-499.439557
Energy at 298.15K
HF Energy	-499.119124
Nuclear repulsion energy	51.098905

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3093	3093	26.19
2	A₁	1392	1392	17.45
3	A₁	759	759	24.03
4	E	3202	3202	8.45
4	E	3202	3202	8.45
5	E	1485	1485	4.27
5	E	1485	1485	4.27
6	E	1036	1036	2.41
6	E	1036	1036	2.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.127
Cl2	0.000	0.000	0.659
H3	0.000	1.041	-1.482
H4	0.902	-0.521	-1.482
H5	-0.902	-0.521	-1.482

	C1	Cl2	H3	H4	H5
C1		1.7857	1.1004	1.1004	1.1004
Cl2	1.7857		2.3810	2.3810	2.3810
H3	1.1004	2.3810		1.8037	1.8037
H4	1.1004	2.3810	1.8037		1.8037
H5	1.1004	2.3810	1.8037	1.8037

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	H3	108.848	Cl2	C1	H4	108.848
Cl2	C1	H5	108.848	H3	C1	H4	110.087
H3	C1	H5	110.087	H4	C1	H5	110.087

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

using model chemistry: QCISD/cc-pV(D+d)Z

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/cc-pV(D+d)Z

States and conformations

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