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	hartrees
Energy at 0K	-116.418300
Energy at 298.15K
HF Energy	-115.901404
Nuclear repulsion energy	59.002033

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	1084	1036
2	B₁	875	837
3	B₂	2015	1926
4	E	3238	3096
5	E	3238	3096
6	E	3155	3016
7	E	3153	3015
8	E	1503	1437
8	E	1457	1393
9	E	1020	975
9	E	1020	975
10	E	825	789
10	E	825	789
11	E	332	318
11	E	331	317

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.000	0.000	1.313
C3	0.000	0.000	-1.313
H4	0.000	0.928	1.872
H5	0.000	-0.928	1.872
H6	0.928	0.000	-1.872
H7	-0.928	0.000	-1.872

	C1	C2	C3	H4	H5	H6	H7
C1		1.3129	1.3129	2.0899	2.0899	2.0899	2.0899
C2	1.3129		2.6258	1.0839	1.0839	3.3178	3.3178
C3	1.3129	2.6258		3.3178	3.3178	1.0839	1.0839
H4	2.0899	1.0839	3.3178		1.8568	3.9683	3.9683
H5	2.0899	1.0839	3.3178	1.8568		3.9683	3.9683
H6	2.0899	3.3178	1.0839	3.9683	3.9683		1.8568
H7	2.0899	3.3178	1.0839	3.9683	3.9683	1.8568

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	121.077	C1	C2	H5	121.077
C1	C3	H6	121.077	C1	C3	H7	121.077
C2	C1	C3	180.000	H4	C2	H5	117.847
H6	C3	H7	117.847

All results from a given calculation for CH₂CCH₂ (allene)

using model chemistry: CCSD(T)=FULL/TZVP

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: CCSD(T)=FULL/TZVP

States and conformations

All results from a given calculation for CH₂CCH₂ (allene)