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	hartrees
Energy at 0K	-132.393963
Energy at 298.15K	-132.396068
HF Energy	-131.897080
Nuclear repulsion energy	59.299533

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3585	3416	22.13
2	A'	3530	3363	83.79
3	A'	2218	2113	90.57
4	A'	1654	1575	35.15
5	A'	1073	1022	12.55
6	A'	720	686	242.06
7	A'	526	501	82.44
8	A'	405	386	10.15
9	A"	3687	3513	36.96
10	A"	1212	1155	0.08
11	A"	635	605	44.61
12	A"	306	292	4.97

Atom	x (Å)	y (Å)	z (Å)
C1	0.112	1.366	0.000
C2	0.000	0.160	0.000
N3	0.001	-1.199	0.000
H4	0.135	2.426	0.000
H5	-0.407	-1.598	0.832
H6	-0.407	-1.598	-0.832

	C1	C2	N3	H4	H5	H6
C1		1.2113	2.5673	1.0596	3.1225	3.1225
C2	1.2113		1.3589	2.2694	1.9875	1.9875
N3	2.5673	1.3589		3.6267	1.0094	1.0094
H4	1.0596	2.2694	3.6267		4.1446	4.1446
H5	3.1225	1.9875	1.0094	4.1446		1.6646
H6	3.1225	1.9875	1.0094	4.1446	1.6646

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.662	C2	C1	H4	175.993
C2	N3	H5	113.297	C2	N3	H6	113.297
H5	N3	H6	111.090

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP2=FULL/TZVP

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=FULL/TZVP

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)