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	hartrees
Energy at 0K	-188.789856
Energy at 298.15K
HF Energy	-188.104161
Nuclear repulsion energy	116.455210

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3572	3425
2	A	3476	3333
3	A	3160	3031
4	A	1758	1686
5	A	1636	1569
6	A	1321	1267
7	A	1293	1240
8	A	1052	1009
9	A	929	891
10	A	893	856
11	A	546	524
12	A	306	293
13	A	253	243
14	B	3571	3425
15	B	3474	3332
16	B	3160	3031
17	B	1646	1578
18	B	1389	1332
19	B	1188	1139
20	B	1135	1088
21	B	855	820
22	B	757	726
23	B	336	322
24	B	251	241

Atom	x (Å)	y (Å)	z (Å)
C1	0.318	0.598	0.029
C2	-0.318	-0.598	0.029
N3	-0.318	1.870	-0.117
N4	0.318	-1.870	-0.117
H5	1.417	0.640	0.028
H6	-1.417	-0.640	0.028
H7	-1.331	1.761	-0.021
H8	1.331	-1.761	-0.021
H9	-0.023	2.494	0.640
H10	0.023	-2.494	0.640

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3549	1.4294	2.4733	1.1006	2.1317	2.0184	2.5688	2.0207	3.1661
C2	1.3549		2.4733	1.4294	2.1317	1.1006	2.5688	2.0184	3.1661	2.0207
N3	1.4294	2.4733		3.7945	2.1318	2.7449	1.0242	3.9898	1.0246	4.4430
N4	2.4733	1.4294	3.7945		2.7449	2.1318	3.9898	1.0242	4.4430	1.0246
H5	1.1006	2.1317	2.1318	2.7449		3.1105	2.9690	2.4036	2.4264	3.4847
H6	2.1317	1.1006	2.7449	2.1318	3.1105		2.4036	2.9690	3.4847	2.4264
H7	2.0184	2.5688	1.0242	3.9898	2.9690	2.4036		4.4158	1.6390	4.5146
H8	2.5688	2.0184	3.9898	1.0242	2.4036	2.9690	4.4158		4.5146	1.6390
H9	2.0207	3.1661	1.0246	4.4430	2.4264	3.4847	1.6390	4.5146		4.9884
H10	3.1661	2.0207	4.4430	1.0246	3.4847	2.4264	4.5146	1.6390	4.9884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.298	C1	C2	H6	120.130
C1	N3	H7	109.596	C1	N3	H9	109.761
C2	C1	N3	125.298	C2	C1	H5	120.130
C2	N4	H8	109.596	C2	N4	H10	109.761
N3	C1	H5	114.211	N4	C2	H6	114.211
H7	N3	H9	106.262	H8	N4	H10	106.262

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: QCISD(T)=FULL/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 H2NCHCHNH2 (diaminoethylene)

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

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)