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	hartrees
Energy at 0K	-132.344393
Energy at 298.15K	-132.346408
HF Energy	-131.874452
Nuclear repulsion energy	58.951135

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3543	3412
2	A'	3455	3327
3	A'	2194	2113
4	A'	1715	1652
5	A'	1054	1014
6	A'	765	736
7	A'	481	463
8	A'	340	328
9	A"	3633	3498
10	A"	1250	1204
11	A"	609	586
12	A"	321	309

Atom	x (Å)	y (Å)	z (Å)
C1	0.079	1.376	0.000
C2	0.000	0.162	0.000
N3	0.033	-1.209	0.000
H4	0.066	2.443	0.000
H5	-0.386	-1.605	0.832
H6	-0.386	-1.605	-0.832

	C1	C2	N3	H4	H5	H6
C1		1.2170	2.5852	1.0673	3.1299	3.1299
C2	1.2170		1.3707	2.2827	1.9908	1.9908
N3	2.5852	1.3707		3.6522	1.0128	1.0128
H4	1.0673	2.2827	3.6522		4.1578	4.1578
H5	3.1299	1.9908	1.0128	4.1578		1.6645
H6	3.1299	1.9908	1.0128	4.1578	1.6645

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	174.891	C2	C1	H4	175.601
C2	N3	H5	112.410	C2	N3	H6	112.410
H5	N3	H6	110.519

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: QCISD(T)/6-311G*

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: QCISD(T)/6-311G*

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)