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	hartrees
Energy at 0K	-37.733894
Energy at 298.15K	-37.737469
HF Energy	-37.465654
Nuclear repulsion energy	40.504838

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3129	3053	13.32
2	A'	2982	2910	31.90
3	A'	1525	1488	11.08
4	A'	1468	1432	2.16
5	A'	1153	1126	1.27
6	A'	941	918	27.98
7	A'	610	595	2.59
8	A'	326	319	4.14
9	A"	3106	3032	44.51
10	A"	1484	1448	7.57
11	A"	1140	1112	1.06
12	A"	243	237	4.39

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.881	0.000
Cl2	-0.845	-0.775	0.000
C3	1.485	0.685	0.000
H4	1.851	1.721	0.000
H5	1.807	0.151	0.906
H6	1.807	0.151	-0.906

	O1	Cl2	C3	H4	H5	H6
O1		1.8596	1.4974	2.0327	2.1494	2.1494
Cl2	1.8596		2.7501	3.6747	2.9524	2.9524
C3	1.4974	2.7501		1.0987	1.1002	1.1002
H4	2.0327	3.6747	1.0987		1.8132	1.8132
H5	2.1494	2.9524	1.1002	1.8132		1.8121
H6	2.1494	2.9524	1.1002	1.8132	1.8121

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C3	H4	101.978	O1	C3	H5	110.745
O1	C3	H6	110.745	Cl2	O1	C3	109.542
H4	C3	H5	111.097	H4	C3	H6	111.097
H5	C3	H6	110.878

All results from a given calculation for CH₃OCl (methyl hypochlorite)

using model chemistry: MP2/CEP-121G

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 CH3OCl (methyl hypochlorite)

using model chemistry: MP2/CEP-121G

States and conformations

All results from a given calculation for CH₃OCl (methyl hypochlorite)