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	hartrees
Energy at 0K	-132.344083
Energy at 298.15K	-132.346021
HF Energy	-131.860017
Nuclear repulsion energy	58.885057

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3590	3590
2	A'	3513	3513
3	A'	2207	2207
4	A'	1685	1685
5	A'	1061	1061
6	A'	721	721
7	A'	475	475
8	A'	323	323
9	A"	3694	3694
10	A"	1226	1226
11	A"	599	599
12	A"	297	297

Atom	x (Å)	y (Å)	z (Å)
C1	0.123	1.377	0.000
C2	0.000	0.163	0.000
N3	-0.004	-1.209	0.000
H4	0.130	2.440	0.000
H5	-0.419	-1.606	0.833
H6	-0.419	-1.606	-0.833

	C1	C2	N3	H4	H5	H6
C1		1.2201	2.5888	1.0635	3.1435	3.1435
C2	1.2201		1.3717	2.2811	1.9991	1.9991
N3	2.5888	1.3717		3.6516	1.0115	1.0115
H4	1.0635	2.2811	3.6516		4.1670	4.1670
H5	3.1435	1.9991	1.0115	4.1670		1.6661
H6	3.1435	1.9991	1.0115	4.1670	1.6661

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.404	C2	C1	H4	174.637
C2	N3	H5	113.168	C2	N3	H6	113.168
H5	N3	H6	110.888

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: QCISD(T)=FULL/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 HCCNH2 (Ethynamine)

using model chemistry: QCISD(T)=FULL/6-31+G**

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)