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	hartrees
Energy at 0K	-997.270959
Energy at 298.15K	-997.272923
HF Energy	-997.270959
Nuclear repulsion energy	188.256067

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3131	3080	2.27
2	A₁	1632	1605	75.51
3	A₁	1373	1351	0.19
4	A₁	593	583	16.70
5	A₁	297	292	0.05
6	A₂	668	657	0.00
7	B₁	826	813	53.16
8	B₁	461	454	3.58
9	B₂	3226	3173	0.00
10	B₂	1067	1049	114.41
11	B₂	758	745	108.23
12	B₂	370	364	0.19

Atom	y (Å)	z (Å)
C1	0.000	1.762
C2	0.000	0.422
H3	0.941	2.315
H4	-0.941	2.315
Cl5	1.466	-0.522
Cl6	-1.466	-0.522

	C1	C2	H3	H4	Cl5	Cl6
C1		1.3393	1.0917	1.0917	2.7133	2.7133
C2	1.3393		2.1137	2.1137	1.7436	1.7436
H3	1.0917	2.1137		1.8821	2.8847	3.7202
H4	1.0917	2.1137	1.8821		3.7202	2.8847
Cl5	2.7133	1.7436	2.8847	3.7202		2.9322
Cl6	2.7133	1.7436	3.7202	2.8847	2.9322

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl5	122.772	C1	C2	Cl6	122.772
C2	C1	H3	120.458	C2	C1	H4	120.458
H3	C1	H4	119.085	Cl5	C2	Cl6	114.457

All results from a given calculation for CH₂CCl₂ (Ethene, 1,1-dichloro-)

using model chemistry: PBEPBEultrafine/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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Number	Element	Mulliken
1	C	-0.312
2	C	-0.193
3	H	0.193
4	H	0.193
5	Cl	0.059
6	Cl	0.059

	x	y	z	Total
	0.000	0.000	1.398	1.398
CHELPG
AIM
ESP

	x	y	z
x	2.766	0.000	0.000
y	0.000	7.541	-0.005
z	0.000	-0.005	7.734

<r²>	136.870
(<r²>)^1/2	11.699

All results from a given calculation for CH2CCl2 (Ethene, 1,1-dichloro-)

using model chemistry: PBEPBEultrafine/6-31G*

States and conformations

All results from a given calculation for CH₂CCl₂ (Ethene, 1,1-dichloro-)