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	hartrees
Energy at 0K	-189.036072
Energy at 298.15K
HF Energy	-188.163493
Nuclear repulsion energy	117.874354

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3664	3664	2.78
2	A	3570	3570	0.46
3	A	3187	3187	0.07
4	A	1792	1792	0.15
5	A	1668	1668	21.36
6	A	1354	1354	0.34
7	A	1301	1301	0.02
8	A	1050	1050	0.25
9	A	955	955	67.08
10	A	812	812	123.85
11	A	557	557	1.68
12	A	317	317	3.17
13	A	242	242	14.04
14	B	3663	3663	10.20
15	B	3569	3569	5.61
16	B	3189	3189	36.32
17	B	1676	1676	53.17
18	B	1411	1411	9.06
19	B	1194	1194	108.57
20	B	1141	1141	0.58
21	B	839	839	91.38
22	B	753	753	246.31
23	B	335	335	25.19
24	B	243	243	98.18

Atom	x (Å)	y (Å)	z (Å)
C1	0.314	0.587	0.028
C2	-0.314	-0.587	0.028
N3	-0.314	1.846	-0.104
N4	0.314	-1.846	-0.104
H5	1.397	0.628	0.028
H6	-1.397	-0.628	0.028
H7	-1.320	1.782	-0.053
H8	1.320	-1.782	-0.053
H9	0.006	2.508	0.587
H10	-0.006	-2.508	0.587

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3313	1.4128	2.4366	1.0837	2.0984	2.0255	2.5750	2.0242	3.1613
C2	1.3313		2.4366	1.4128	2.0984	1.0837	2.5750	2.0255	3.1613	2.0242
N3	1.4128	2.4366		3.7449	2.1037	2.7042	1.0091	3.9790	1.0088	4.4191
N4	2.4366	1.4128	3.7449		2.7042	2.1037	3.9790	1.0091	4.4191	1.0088
H5	1.0837	2.0984	2.1037	2.7042		3.0631	2.9522	2.4130	2.4041	3.4809
H6	2.0984	1.0837	2.7042	2.1037	3.0631		2.4130	2.9522	3.4809	2.4041
H7	2.0255	2.5750	1.0091	3.9790	2.9522	2.4130		4.4347	1.6412	4.5321
H8	2.5750	2.0255	3.9790	1.0091	2.4130	2.9522	4.4347		4.5321	1.6412
H9	2.0242	3.1613	1.0088	4.4191	2.4041	3.4809	1.6412	4.5321		5.0159
H10	3.1613	2.0242	4.4191	1.0088	3.4809	2.4041	4.5321	1.6412	5.0159

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.195	C1	C2	H6	120.319
C1	N3	H7	112.434	C1	N3	H9	112.340
C2	C1	N3	125.195	C2	C1	H5	120.319
C2	N4	H8	112.434	C2	N4	H10	112.340
N3	C1	H5	114.197	N4	C2	H6	114.197
H7	N3	H9	108.843	H8	N4	H10	108.843

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: CCSD=FULL/6-311+G(3df,2p)

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: CCSD=FULL/6-311+G(3df,2p)

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)