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	hartrees
Energy at 0K	-132.303709
Energy at 298.15K	-132.305707
HF Energy	-131.842036
Nuclear repulsion energy	58.841133

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3506	3403
2	A'	3490	3388
3	A'	2227	2162
4	A'	1695	1646
5	A'	1063	1032
6	A'	761	739
7	A'	487	473
8	A'	358	348
9	A"	3599	3493
10	A"	1240	1203
11	A"	593	575
12	A"	305	296

Atom	x (Å)	y (Å)	z (Å)
C1	0.123	1.375	0.000
C2	0.000	0.163	0.000
N3	0.005	-1.211	0.000
H4	0.101	2.443	0.000
H5	-0.437	-1.598	0.832
H6	-0.437	-1.598	-0.832

	C1	C2	N3	H4	H5	H6
C1		1.2175	2.5879	1.0683	3.1371	3.1371
C2	1.2175		1.3740	2.2815	1.9962	1.9962
N3	2.5879	1.3740		3.6545	1.0183	1.0183
H4	1.0683	2.2815	3.6545		4.1602	4.1602
H5	3.1371	1.9962	1.0183	4.1602		1.6634
H6	3.1371	1.9962	1.0183	4.1602	1.6634

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	173.988	C2	C1	H4	172.984
C2	N3	H5	112.258	C2	N3	H6	112.258
H5	N3	H6	109.520

All results from a given calculation for HCCNH₂ (Ethynamine)

using model chemistry: CCSD(T)=FULL/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(T)=FULL/6-31G*

States and conformations

All results from a given calculation for HCCNH₂ (Ethynamine)