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	hartrees
Energy at 0K	-132.592845
Energy at 298.15K	-132.588028
HF Energy	-131.845571
Nuclear repulsion energy	59.872631

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3771	3553	24.44
2	A'	3673	3461	79.47
3	A'	2431	2291	83.47
4	A'	1815	1710	36.66
5	A'	1138	1072	12.87
6	A'	752	709	275.32
7	A'	645	608	91.28
8	A'	506	477	41.75
9	A"	3868	3645	36.52
10	A"	1330	1254	0.03
11	A"	832	784	40.90
12	A"	426	401	5.25

Atom	x (Å)	y (Å)	z (Å)
C1	0.104	1.374	0.000
C2	0.000	0.161	0.000
N3	0.016	-1.206	0.000
H4	0.084	2.439	0.000
H5	-0.411	-1.604	0.831
H6	-0.411	-1.604	-0.831

	C1	C2	N3	H4	H5	H6
C1		1.2180	2.5822	1.0643	3.1346	3.1346
C2	1.2180		1.3672	2.2793	1.9934	1.9934
N3	2.5822	1.3672		3.6455	1.0155	1.0155
H4	1.0643	2.2793	3.6455		4.1566	4.1566
H5	3.1346	1.9934	1.0155	4.1566		1.6623
H6	3.1346	1.9934	1.0155	4.1566	1.6623

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	179.197	C2	C1	H4	179.042
C2	N3	H5	112.353	C2	N3	H6	112.353
H5	N3	H6	111.971

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: G3

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: G3

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)