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	hartrees
Energy at 0K	-132.430702
Energy at 298.15K	-132.432948
HF Energy	-131.902347
Nuclear repulsion energy	59.487805

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3608	3409	21.60
2	A'	3533	3338	87.32
3	A'	2290	2163	95.03
4	A'	1671	1578	27.22
5	A'	1081	1021	12.86
6	A'	714	674	199.41
7	A'	535	506	94.02
8	A'	435	411	9.64
9	A"	3696	3491	34.95
10	A"	1238	1170	0.53
11	A"	694	656	40.06
12	A"	371	351	6.16

Atom	x (Å)	y (Å)	z (Å)
C1	-0.036	1.364	0.000
C2	0.000	0.164	0.000
N3	0.118	-1.193	0.000
H4	-0.077	2.421	0.000
H5	-0.269	-1.616	0.826
H6	-0.269	-1.616	-0.826

	C1	C2	N3	H4	H5	H6
C1		1.2006	2.5614	1.0582	3.1012	3.1012
C2	1.2006		1.3619	2.2587	1.9808	1.9808
N3	2.5614	1.3619		3.6195	1.0060	1.0060
H4	1.0582	2.2587	3.6195		4.1256	4.1256
H5	3.1012	1.9808	1.0060	4.1256		1.6524
H6	3.1012	1.9808	1.0060	4.1256	1.6524

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.709	C2	C1	H4	179.469
C2	N3	H5	112.678	C2	N3	H6	112.678
H5	N3	H6	110.417

All results from a given calculation for HCCNH₂ (Ethynamine)

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

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)