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	hartrees
Energy at 0K	-132.274942
Energy at 298.15K	-132.276957
HF Energy	-131.842916
Nuclear repulsion energy	58.943658

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3535	3338	9.79
2	A'	3509	3314	63.48
3	A'	2266	2140	53.56
4	A'	1705	1610	32.34
5	A'	1073	1013	6.88
6	A'	764	721	260.36
7	A'	494	467	64.37
8	A'	355	335	21.06
9	A"	3626	3424	18.04
10	A"	1248	1179	0.02
11	A"	607	573	36.84
12	A"	309	291	1.40

Atom	x (Å)	y (Å)	z (Å)
C1	0.071	1.375	0.000
C2	0.000	0.164	0.000
N3	0.043	-1.209	0.000
H4	0.036	2.442	0.000
H5	-0.384	-1.609	0.831
H6	-0.384	-1.609	-0.831

	C1	C2	N3	H4	H5	H6
C1		1.2126	2.5838	1.0671	3.1309	3.1309
C2	1.2126		1.3738	2.2774	1.9959	1.9959
N3	2.5838	1.3738		3.6502	1.0167	1.0167
H4	1.0671	2.2774	3.6502		4.1563	4.1563
H5	3.1309	1.9959	1.0167	4.1563		1.6621
H6	3.1309	1.9959	1.0167	4.1563	1.6621

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.818	C2	C1	H4	174.743
C2	N3	H5	112.353	C2	N3	H6	112.353
H5	N3	H6	109.655

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: CCSD/6-31G*

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: CCSD/6-31G*

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)