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	hartrees
Energy at 0K	-132.299482
Energy at 298.15K	-132.301681
HF Energy	-131.860232
Nuclear repulsion energy	58.782665

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3574	3388	12.49
2	A'	3526	3343	79.93
3	A'	2283	2164	71.35
4	A'	1654	1568	22.07
5	A'	1071	1016	8.85
6	A'	792	751	200.08
7	A'	531	504	75.29
8	A'	393	372	8.63
9	A"	3661	3470	22.25
10	A"	1243	1179	0.74
11	A"	677	642	34.03
12	A"	352	334	3.90

Atom	x (Å)	y (Å)	z (Å)
C1	-0.066	1.378	0.000
C2	0.000	0.162	0.000
N3	0.154	-1.207	0.000
H4	-0.133	2.449	0.000
H5	-0.277	-1.619	0.826
H6	-0.277	-1.619	-0.826

	C1	C2	N3	H4	H5	H6
C1		1.2184	2.5944	1.0733	3.1163	3.1163
C2	1.2184		1.3771	2.2917	1.9824	1.9824
N3	2.5944	1.3771		3.6675	1.0189	1.0189
H4	1.0733	2.2917	3.6675		4.1541	4.1541
H5	3.1163	1.9824	1.0189	4.1541		1.6518
H6	3.1163	1.9824	1.0189	4.1541	1.6518

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.651	C2	C1	H4	179.479
C2	N3	H5	110.778	C2	N3	H6	110.778
H5	N3	H6	108.307

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP3/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: MP3/cc-pVDZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)