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	hartrees
Energy at 0K	-132.322885
Energy at 298.15K	-132.324912
HF Energy	-131.858183
Nuclear repulsion energy	58.447660

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3506	3342
2	A'	3474	3311
3	A'	2191	2089
4	A'	1635	1558
5	A'	1044	995
6	A'	801	763
7	A'	486	463
8	A'	327	311
9	A"	3596	3428
10	A"	1229	1172
11	A"	625	596
12	A"	318	303

Atom	x (Å)	y (Å)	z (Å)
C1	-0.032	1.389	0.000
C2	0.000	0.160	0.000
N3	0.130	-1.217	0.000
H4	-0.078	2.465	0.000
H5	-0.322	-1.617	0.827
H6	-0.322	-1.617	-0.827

	C1	C2	N3	H4	H5	H6
C1		1.2296	2.6110	1.0769	3.1303	3.1303
C2	1.2296		1.3829	2.3064	1.9852	1.9852
N3	2.6110	1.3829		3.6878	1.0232	1.0232
H4	1.0769	2.3064	3.6878		4.1712	4.1712
H5	3.1303	1.9852	1.0232	4.1712		1.6532
H6	3.1303	1.9852	1.0232	4.1712	1.6532

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	176.076	C2	C1	H4	179.030
C2	N3	H5	110.296	C2	N3	H6	110.296
H5	N3	H6	107.780

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: QCISD(T)/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: QCISD(T)/cc-pVDZ

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)