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	hartrees
Energy at 0K	-132.429197
Energy at 298.15K	-132.431307
HF Energy	-131.902959
Nuclear repulsion energy	59.240185

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3562	3394	21.49
2	A'	3503	3338	88.54
3	A'	2193	2089	104.81
4	A'	1644	1567	25.41
5	A'	1068	1017	14.17
6	A'	676	644	181.20
7	A'	507	484	91.45
8	A'	389	371	5.91
9	A"	3661	3489	47.19
10	A"	1208	1152	0.67
11	A"	644	614	41.19
12	A"	347	331	5.45

Atom	x (Å)	y (Å)	z (Å)
C1	-0.015	1.373	0.000
C2	0.000	0.159	0.000
N3	0.098	-1.196	0.000
H4	-0.037	2.433	0.000
H5	-0.282	-1.625	0.831
H6	-0.282	-1.625	-0.831

	C1	C2	N3	H4	H5	H6
C1		1.2137	2.5717	1.0599	3.1226	3.1226
C2	1.2137		1.3593	2.2736	1.9886	1.9886
N3	2.5717	1.3593		3.6315	1.0096	1.0096
H4	1.0599	2.2736	3.6315		4.1492	4.1492
H5	3.1226	1.9886	1.0096	4.1492		1.6619
H6	3.1226	1.9886	1.0096	4.1492	1.6619

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.536	C2	C1	H4	179.491
C2	N3	H5	113.343	C2	N3	H6	113.343
H5	N3	H6	110.777

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: MP2/aug-cc-pVTZ

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/aug-cc-pVTZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)