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	hartrees
Energy at 0K	-187.964630
Energy at 298.15K
HF Energy	-187.830337
Nuclear repulsion energy	116.778302

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3582	3582	0.84
2	A	3473	3473	0.80
3	A	3175	3175	0.11
4	A	1740	1740	2.29
5	A	1722	1722	14.89
6	A	1372	1372	1.67
7	A	1293	1293	0.08
8	A	1030	1030	0.64
9	A	959	959	79.44
10	A	647	647	299.34
11	A	561	561	3.05
12	A	344	344	0.74
13	A	253	253	25.10
14	B	3582	3582	1.31
15	B	3471	3471	1.61
16	B	3180	3180	48.60
17	B	1730	1730	53.38
18	B	1424	1424	2.36
19	B	1170	1170	59.58
20	B	1150	1150	24.58
21	B	805	805	20.14
22	B	574	574	420.04
23	B	342	342	33.02
24	B	209	209	204.62

Atom	x (Å)	y (Å)	z (Å)
C1	0.315	0.593	0.040
C2	-0.315	-0.593	0.040
N3	-0.315	1.861	-0.096
N4	0.315	-1.861	-0.096
H5	1.401	0.633	0.049
H6	-1.401	-0.633	0.049
H7	-1.330	1.832	-0.165
H8	1.330	-1.832	-0.165
H9	0.013	2.580	0.544
H10	-0.013	-2.580	0.544

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3431	1.4223	2.4578	1.0863	2.1089	2.0695	2.6371	2.0723	3.2300
C2	1.3431		2.4578	1.4223	2.1089	1.0863	2.6371	2.0695	3.2300	2.0723
N3	1.4223	2.4578		3.7748	2.1144	2.7241	1.0175	4.0434	1.0174	4.4973
N4	2.4578	1.4223	3.7748		2.7241	2.1144	4.0434	1.0175	4.4973	1.0174
H5	1.0863	2.1089	2.1144	2.7241		3.0742	2.9895	2.4759	2.4414	3.5458
H6	2.1089	1.0863	2.7241	2.1144	3.0742		2.4759	2.9895	3.5458	2.4414
H7	2.0695	2.6371	1.0175	4.0434	2.9895	2.4759		4.5278	1.6932	4.6591
H8	2.6371	2.0695	4.0434	1.0175	2.4759	2.9895	4.5278		4.6591	1.6932
H9	2.0723	3.2300	1.0174	4.4973	2.4414	3.5458	1.6932	4.6591		5.1608
H10	3.2300	2.0723	4.4973	1.0174	3.5458	2.4414	4.6591	1.6932	5.1608

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.411	C1	C2	H6	120.103
C1	N3	H7	115.035	C1	N3	H9	115.290
C2	C1	N3	125.411	C2	C1	H5	120.103
C2	N4	H8	115.035	C2	N4	H10	115.290
N3	C1	H5	114.224	N4	C2	H6	114.224
H7	N3	H9	112.630	H8	N4	H10	112.630

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: B2PLYP=FULLultrafine/3-21G*

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 H2NCHCHNH2 (diaminoethylene)

using model chemistry: B2PLYP=FULLultrafine/3-21G*

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)