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	hartrees
Energy at 0K	-132.357377
Energy at 298.15K	-132.359238
HF Energy	-131.867035
Nuclear repulsion energy	58.518624

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3511	3410
2	A'	3462	3362
3	A'	2179	2116
4	A'	1630	1583
5	A'	1043	1013
6	A'	695	675
7	A'	465	452
8	A'	282	274
9	A"	3607	3503
10	A"	1206	1171
11	A"	585	568
12	A"	290	282

Atom	x (Å)	y (Å)	z (Å)
C1	0.017	1.390	0.000
C2	0.000	0.160	0.000
N3	0.080	-1.215	0.000
H4	0.005	2.465	0.000
H5	-0.333	-1.629	0.834
H6	-0.333	-1.629	-0.834

	C1	C2	N3	H4	H5	H6
C1		1.2300	2.6058	1.0749	3.1520	3.1520
C2	1.2300		1.3775	2.3047	2.0023	2.0023
N3	2.6058	1.3775		3.6806	1.0188	1.0188
H4	1.0749	2.3047	3.6806		4.1919	4.1919
H5	3.1520	2.0023	1.0188	4.1919		1.6683
H6	3.1520	2.0023	1.0188	4.1919	1.6683

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.883	C2	C1	H4	178.540
C2	N3	H5	112.494	C2	N3	H6	112.494
H5	N3	H6	109.928

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: CCSD(T)=FULL/aug-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 HCCNH2 (Ethynamine)

using model chemistry: CCSD(T)=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)