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	hartrees
Energy at 0K	-187.514301
Energy at 298.15K	-187.518338
HF Energy	-186.914634
Nuclear repulsion energy	101.515160

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3686	3503	18.61
2	A	3588	3410	3.01
3	A	2384	2265	0.23
4	A	1729	1643	18.82
5	A	1251	1188	0.09
6	A	822	781	19.00
7	A	696	661	126.01
8	A	385	366	0.04
9	A	346	329	39.82
10	A	203	193	16.34
11	B	3686	3503	17.57
12	B	3590	3412	10.74
13	B	1728	1642	41.83
14	B	1370	1302	83.85
15	B	1250	1187	0.12
16	B	753	716	406.23
17	B	379	360	15.01
18	B	203	193	19.63

Atom	x (Å)	y (Å)	z (Å)
C1	0.003	0.608	0.059
C2	-0.003	-0.608	0.059
N3	-0.003	1.962	-0.089
N4	0.003	-1.962	-0.089
H5	-0.324	2.467	0.722
H6	0.857	2.344	-0.452
H7	0.324	-2.467	0.722
H8	-0.857	-2.344	-0.452

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2163	1.3618	2.5742	2.0004	2.0006	3.1620	3.1171
C2	1.2163		2.5742	1.3618	3.1620	3.1171	2.0004	2.0006
N3	1.3618	2.5742		3.9236	1.0084	1.0086	4.5142	4.4045
N4	2.5742	1.3618	3.9236		4.5142	4.4045	1.0084	1.0086
H5	2.0004	3.1620	1.0084	4.5142		1.6699	4.9760	4.9804
H6	2.0006	3.1171	1.0086	4.4045	1.6699		4.9804	4.9914
H7	3.1620	2.0004	4.5142	1.0084	4.9760	4.9804		1.6699
H8	3.1171	2.0006	4.4045	1.0086	4.9804	4.9914	1.6699

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	173.712	C1	N3	H5	114.305
C1	N3	H6	114.309	C2	C1	N3	173.712
C2	N4	H7	114.305	C2	N4	H8	114.309
H5	N3	H6	111.772	H7	N4	H8	111.772

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: MP2/6-311G*

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 NH2CCNH2 (Diaminoacetylene)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)