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	hartrees
Energy at 0K	-959.754403
Energy at 298.15K	-959.756900
HF Energy	-959.754403
Nuclear repulsion energy	133.957870

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3138	3007	5.76	101.37	0.05	0.09
2	A₁	1429	1369	0.24	6.15	0.70	0.82
3	A₁	728	698	11.49	16.23	0.07	0.12
4	A₁	286	275	0.47	3.96	0.42	0.60
5	A₂	1163	1114	0.00	1.79	0.75	0.86
6	B₁	3228	3094	0.35	49.10	0.75	0.86
7	B₁	895	858	1.44	0.45	0.75	0.86
8	B₂	1267	1214	36.12	0.03	0.75	0.86
9	B₂	767	735	146.17	3.54	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.768
H2	-0.905	0.000	1.377
H3	0.905	0.000	1.377
Cl4	0.000	1.477	-0.217
Cl5	0.000	-1.477	-0.217

	C1	H2	H3	Cl4	Cl5
C1		1.0911	1.0911	1.7755	1.7755
H2	1.0911		1.8107	2.3543	2.3543
H3	1.0911	1.8107		2.3543	2.3543
Cl4	1.7755	2.3543	2.3543		2.9546
Cl5	1.7755	2.3543	2.3543	2.9546

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	H3	112.143	H2	C1	Cl4	108.036
H2	C1	Cl5	108.036	H3	C1	Cl4	108.036
H3	C1	Cl5	108.036	Cl4	C1	Cl5	112.621

All results from a given calculation for CH₂Cl₂ (Methylene chloride)

using model chemistry: mPW1PW91/aug-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	-0.238
2	H	0.117
3	H	0.117
4	Cl	0.002
5	Cl	0.002

	x	y	z	Total
	0.000	0.000	1.703	1.703
CHELPG
AIM
ESP

<r²>	104.560
(<r²>)^1/2	10.225

All results from a given calculation for CH2Cl2 (Methylene chloride)

using model chemistry: mPW1PW91/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂Cl₂ (Methylene chloride)