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	hartrees
Energy at 0K	-115.431940
Energy at 298.15K	-115.435145
HF Energy	-115.159752
Nuclear repulsion energy	62.870096

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	3367	3203	0.15	118.13	0.12	0.22
2	A₁	3163	3009	28.25	93.41	0.15	0.26
3	A₁	1661	1580	13.21	10.13	0.46	0.63
4	A₁	1582	1505	0.00	15.68	0.23	0.38
5	A₁	1132	1077	1.11	5.10	0.15	0.26
6	A₁	936	891	2.10	12.47	0.47	0.64
7	A₂	1057	1006	0.00	19.26	0.75	0.86
8	A₂	862	820	0.00	0.01	0.75	0.86
9	B₁	3250	3092	34.27	64.37	0.75	0.86
10	B₁	1139	1084	2.06	4.10	0.75	0.86
11	B₁	621	590	96.60	1.45	0.75	0.86
12	B₂	3319	3157	0.00	61.19	0.75	0.86
13	B₂	1140	1084	0.23	0.00	0.75	0.86
14	B₂	1108	1054	69.15	1.10	0.75	0.86
15	B₂	703	669	6.59	16.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.891
C2	0.000	0.656	-0.513
C3	0.000	-0.656	-0.513
H4	0.000	1.576	-1.064
H5	0.000	-1.576	-1.064
H6	0.918	0.000	1.469
H7	-0.918	0.000	1.469

	C1	C2	C3	H4	H5	H6	H7
C1		1.5495	1.5495	2.5111	2.5111	1.0848	1.0848
C2	1.5495		1.3127	1.0723	2.2996	2.2805	2.2805
C3	1.5495	1.3127		2.2996	1.0723	2.2805	2.2805
H4	2.5111	1.0723	2.2996		3.1525	3.1212	3.1212
H5	2.5111	2.2996	1.0723	3.1525		3.1212	3.1212
H6	1.0848	2.2805	2.2805	3.1212	3.1212		1.8361
H7	1.0848	2.2805	2.2805	3.1212	3.1212	1.8361

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	64.939	C1	C2	H4	145.986
C1	C3	C2	64.939	C1	C3	H5	145.986
C2	C1	C3	50.121	C2	C1	H6	118.857
C2	C1	H7	118.857	C2	C3	H5	149.075
C3	C1	H6	118.857	C3	C1	H7	118.857
C3	C2	H4	149.075	H6	C1	H7	115.613

All results from a given calculation for C₃H₄ (cyclopropene)

using model chemistry: MP2/3-21G*

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 C3H4 (cyclopropene)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for C₃H₄ (cyclopropene)