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	hartrees
Energy at 0K	-116.296185
Energy at 298.15K
HF Energy	-115.870783
Nuclear repulsion energy	58.514384

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3174	3037	0.00
2	A₁	1499	1434	0.00
3	A₁	1104	1056	0.00
4	B₁	872	834	0.00
5	B₂	3173	3036	2.58
6	B₂	2069	1980	24.56
7	B₂	1439	1376	1.50
8	E	3267	3126	2.15
8	E	3267	3126	2.15
9	E	1027	982	1.15
9	E	1027	982	1.15
10	E	866	829	47.69
10	E	866	829	47.69
11	E	355	340	3.95
11	E	355	340	3.95

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.000	0.000	1.322
C3	0.000	0.000	-1.322
H4	0.000	0.940	1.887
H5	0.000	-0.940	1.887
H6	0.940	0.000	-1.887
H7	-0.940	0.000	-1.887

	C1	C2	C3	H4	H5	H6	H7
C1		1.3225	1.3225	2.1077	2.1077	2.1077	2.1077
C2	1.3225		2.6450	1.0961	1.0961	3.3438	3.3438
C3	1.3225	2.6450		3.3438	3.3438	1.0961	1.0961
H4	2.1077	1.0961	3.3438		1.8798	4.0004	4.0004
H5	2.1077	1.0961	3.3438	1.8798		4.0004	4.0004
H6	2.1077	3.3438	1.0961	4.0004	4.0004		1.8798
H7	2.1077	3.3438	1.0961	4.0004	4.0004	1.8798

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	120.969	C1	C2	H5	120.969
C1	C3	H6	120.969	C1	C3	H7	120.969
C2	C1	C3	180.000	H4	C2	H5	118.062
H6	C3	H7	118.062

All results from a given calculation for CH₂CCH₂ (allene)

using model chemistry: CCD/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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All results from a given calculation for CH2CCH2 (allene)

using model chemistry: CCD/cc-pVDZ

States and conformations

All results from a given calculation for CH₂CCH₂ (allene)