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	hartrees
Energy at 0K	-132.094826
Energy at 298.15K	-132.096251
HF Energy	-131.813488
Nuclear repulsion energy	58.192336

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3642	3507	54.72
2	A'	3497	3368	61.76
3	A'	2178	2098	115.28
4	A'	1700	1637	54.12
5	A'	1055	1016	21.29
6	A'	501	482	118.46
7	A'	384	370	10.30
8	A'	63	60	468.02
9	A"	3781	3642	49.79
10	A"	1170	1127	9.36
11	A"	677	652	63.88
12	A"	351	338	9.91

Atom	x (Å)	y (Å)	z (Å)
C1	-0.007	1.409	0.000
C2	0.000	0.165	0.000
N3	0.010	-1.210	0.000
H4	-0.007	2.478	0.000
H5	-0.008	-1.725	0.871
H6	-0.008	-1.725	-0.871

	C1	C2	N3	H4	H5	H6
C1		1.2433	2.6187	1.0692	3.2526	3.2526
C2	1.2433		1.3753	2.3125	2.0814	2.0814
N3	2.6187	1.3753		3.6878	1.0118	1.0118
H4	1.0692	2.3125	3.6878		4.2923	4.2923
H5	3.2526	2.0814	1.0118	4.2923		1.7410
H6	3.2526	2.0814	1.0118	4.2923	1.7410

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	179.935	C2	C1	H4	179.662
C2	N3	H5	120.612	C2	N3	H6	120.612
H5	N3	H6	118.718

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP2/LANL2DZ

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: MP2/LANL2DZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)