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	hartrees
Energy at 0K	-132.354063
Energy at 298.15K	-132.356215
HF Energy	-131.898240
Nuclear repulsion energy	59.468069

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3623	3388	19.55
2	A'	3550	3320	82.95
3	A'	2301	2152	94.41
4	A'	1676	1568	35.13
5	A'	1082	1012	12.93
6	A'	732	685	238.56
7	A'	537	502	88.03
8	A'	416	389	10.71
9	A"	3714	3473	30.19
10	A"	1233	1153	0.40
11	A"	661	618	43.11
12	A"	312	292	5.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.076	1.362	0.000
C2	0.000	0.164	0.000
N3	0.030	-1.197	0.000
H4	0.078	2.421	0.000
H5	-0.372	-1.600	0.831
H6	-0.372	-1.600	-0.831

	C1	C2	N3	H4	H5	H6
C1		1.2004	2.5602	1.0590	3.1090	3.1090
C2	1.2004		1.3621	2.2584	1.9853	1.9853
N3	2.5602	1.3621		3.6191	1.0070	1.0070
H4	1.0590	2.2584	3.6191		4.1308	4.1308
H5	3.1090	1.9853	1.0070	4.1308		1.6613
H6	3.1090	1.9853	1.0070	4.1308	1.6613

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	175.111	C2	C1	H4	176.510
C2	N3	H5	113.001	C2	N3	H6	113.001
H5	N3	H6	111.161

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP3/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: MP3/TZVP

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)