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	hartrees
Energy at 0K	-188.891201
Energy at 298.15K
HF Energy	-188.112793
Nuclear repulsion energy	117.792085

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3671	3457	1.67
2	A	3577	3368	2.38
3	A	3213	3026	0.04
4	A	1809	1703	0.00
5	A	1685	1587	24.04
6	A	1365	1285	0.74
7	A	1317	1241	0.30
8	A	1061	999	1.95
9	A	978	921	51.88
10	A	867	816	115.46
11	A	561	529	0.69
12	A	324	305	0.33
13	A	256	241	15.12
14	B	3671	3456	4.73
15	B	3575	3367	1.70
16	B	3214	3026	36.53
17	B	1693	1594	44.48
18	B	1426	1342	7.88
19	B	1209	1139	66.28
20	B	1153	1086	0.45
21	B	860	810	195.76
22	B	791	745	203.21
23	B	344	324	37.45
24	B	256	241	87.84

Atom	x (Å)	y (Å)	z (Å)
C1	0.313	0.588	0.024
C2	-0.313	-0.588	0.024
N3	-0.313	1.851	-0.106
N4	0.313	-1.851	-0.106
H5	1.396	0.631	0.025
H6	-1.396	-0.631	0.025
H7	-1.318	1.771	-0.040
H8	1.318	-1.771	-0.040
H9	-0.004	2.490	0.613
H10	0.004	-2.490	0.613

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3314	1.4151	2.4419	1.0847	2.0991	2.0155	2.5649	2.0161	3.1485
C2	1.3314		2.4419	1.4151	2.0991	1.0847	2.5649	2.0155	3.1485	2.0161
N3	1.4151	2.4419		3.7536	2.1034	2.7114	1.0106	3.9722	1.0105	4.4110
N4	2.4419	1.4151	3.7536		2.7114	2.1034	3.9722	1.0106	4.4110	1.0105
H5	1.0847	2.0991	2.1034	2.7114		3.0648	2.9445	2.4044	2.4003	3.4677
H6	2.0991	1.0847	2.7114	2.1034	3.0648		2.4044	2.9445	3.4677	2.4003
H7	2.0155	2.5649	1.0106	3.9722	2.9445	2.4044		4.4150	1.6335	4.5087
H8	2.5649	2.0155	3.9722	1.0106	2.4044	2.9445	4.4150		4.5087	1.6335
H9	2.0161	3.1485	1.0105	4.4110	2.4003	3.4677	1.6335	4.5087		4.9797
H10	3.1485	2.0161	4.4110	1.0105	3.4677	2.4003	4.5087	1.6335	4.9797

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.491	C1	C2	H6	120.298
C1	N3	H7	111.283	C1	N3	H9	111.342
C2	C1	N3	125.491	C2	C1	H5	120.298
C2	N4	H8	111.283	C2	N4	H10	111.342
N3	C1	H5	113.930	N4	C2	H6	113.930
H7	N3	H9	107.842	H8	N4	H10	107.842

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

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

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)