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	hartrees
Energy at 0K	-188.888712
Energy at 298.15K
HF Energy	-188.113008
Nuclear repulsion energy	117.916303

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3701	3701	2.17
2	A	3607	3607	3.11
3	A	3236	3236	0.05
4	A	1818	1818	0.00
5	A	1689	1689	24.51
6	A	1369	1369	0.71
7	A	1321	1321	0.25
8	A	1064	1064	1.66
9	A	982	982	53.01
10	A	864	864	119.96
11	A	564	564	0.76
12	A	326	326	0.36
13	A	258	258	15.24
14	B	3700	3700	6.52
15	B	3606	3606	3.17
16	B	3237	3237	36.06
17	B	1697	1697	48.06
18	B	1430	1430	7.99
19	B	1214	1214	69.68
20	B	1156	1156	0.36
21	B	861	861	170.41
22	B	791	791	229.12
23	B	346	346	38.73
24	B	257	257	88.14

Atom	x (Å)	y (Å)	z (Å)
C1	0.313	0.587	0.024
C2	-0.313	-0.587	0.024
N3	-0.313	1.849	-0.106
N4	0.313	-1.849	-0.106
H5	1.395	0.629	0.024
H6	-1.395	-0.629	0.024
H7	-1.316	1.770	-0.039
H8	1.316	-1.770	-0.039
H9	-0.002	2.489	0.609
H10	0.002	-2.489	0.609

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3298	1.4142	2.4390	1.0833	2.0964	2.0138	2.5620	2.0144	3.1461
C2	1.3298		2.4390	1.4142	2.0964	1.0833	2.5620	2.0138	3.1461	2.0144
N3	1.4142	2.4390		3.7498	2.1023	2.7072	1.0090	3.9684	1.0088	4.4072
N4	2.4390	1.4142	3.7498		2.7072	2.1023	3.9684	1.0090	4.4072	1.0088
H5	1.0833	2.0964	2.1023	2.7072		3.0607	2.9418	2.4009	2.3980	3.4649
H6	2.0964	1.0833	2.7072	2.1023	3.0607		2.4009	2.9418	3.4649	2.3980
H7	2.0138	2.5620	1.0090	3.9684	2.9418	2.4009		4.4107	1.6324	4.5044
H8	2.5620	2.0138	3.9684	1.0090	2.4009	2.9418	4.4107		4.5044	1.6324
H9	2.0144	3.1461	1.0088	4.4072	2.3980	3.4649	1.6324	4.5044		4.9776
H10	3.1461	2.0144	4.4072	1.0088	3.4649	2.3980	4.5044	1.6324	4.9776

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.428	C1	C2	H6	120.287
C1	N3	H7	111.319	C1	N3	H9	111.379
C2	C1	N3	125.428	C2	C1	H5	120.287
C2	N4	H8	111.319	C2	N4	H10	111.379
N3	C1	H5	114.000	N4	C2	H6	114.000
H7	N3	H9	107.994	H8	N4	H10	107.994

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: MP3=FULL/6-31G(2df,p)

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: MP3=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)