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	hartrees
Energy at 0K	-116.307037
Energy at 298.15K
HF Energy	-115.872958
Nuclear repulsion energy	58.871514

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3212	3036	0.00
2	A₁	1531	1448	0.00
3	A₁	1102	1042	0.00
4	B₁	885	837	0.00
5	B₂	3211	3035	4.30
6	B₂	2049	1937	44.26
7	B₂	1480	1399	0.76
8	E	3299	3119	2.78
8	E	3299	3119	2.78
9	E	1047	989	1.94
9	E	1047	989	1.94
10	E	874	826	59.35
10	E	874	826	59.35
11	E	344	325	7.70
11	E	344	325	7.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.000	0.000	1.318
C3	0.000	0.000	-1.318
H4	0.000	0.927	1.876
H5	0.000	-0.927	1.876
H6	0.927	0.000	-1.876
H7	-0.927	0.000	-1.876

	C1	C2	C3	H4	H5	H6	H7
C1		1.3175	1.3175	2.0928	2.0928	2.0928	2.0928
C2	1.3175		2.6351	1.0824	1.0824	3.3257	3.3257
C3	1.3175	2.6351		3.3257	3.3257	1.0824	1.0824
H4	2.0928	1.0824	3.3257		1.8541	3.9750	3.9750
H5	2.0928	1.0824	3.3257	1.8541		3.9750	3.9750
H6	2.0928	3.3257	1.0824	3.9750	3.9750		1.8541
H7	2.0928	3.3257	1.0824	3.9750	3.9750	1.8541

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	121.080	C1	C2	H5	121.080
C1	C3	H6	121.080	C1	C3	H7	121.080
C2	C1	C3	180.000	H4	C2	H5	117.841
H6	C3	H7	117.841

All results from a given calculation for CH₂CCH₂ (allene)

using model chemistry: QCISD/6-31+G**

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: QCISD/6-31+G**

States and conformations

All results from a given calculation for CH₂CCH₂ (allene)