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	hartrees
Energy at 0K	-188.599054
Energy at 298.15K	-188.609307
Nuclear repulsion energy	130.305971

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3500	3295	0.00
2	A_g	3104	2922	0.00
3	A_g	1785	1681	0.00
4	A_g	1587	1494	0.00
5	A_g	1454	1368	0.00
6	A_g	1127	1061	0.00
7	A_g	1031	971	0.00
8	A_g	780	734	0.00
9	A_g	468	441	0.00
10	A_u	3592	3381	1.04
11	A_u	3162	2976	62.99
12	A_u	1451	1366	2.77
13	A_u	1123	1057	0.13
14	A_u	777	731	0.58
15	A_u	286	269	139.51
16	A_u	153	144	0.55
17	B_g	3592	3382	0.00
18	B_g	3133	2949	0.00
19	B_g	1430	1346	0.00
20	B_g	1368	1288	0.00
21	B_g	975	918	0.00
22	B_g	311	293	0.00
23	B_u	3497	3292	2.29
24	B_u	3109	2926	70.32
25	B_u	1785	1681	41.46
26	B_u	1604	1510	1.66
27	B_u	1390	1309	7.68
28	B_u	1087	1024	11.16
29	B_u	802	755	540.76
30	B_u	272	257	20.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.410	0.659	0.000
C2	-0.410	-0.659	0.000
N3	-0.410	1.897	0.000
N4	0.410	-1.897	0.000
H5	0.992	-1.964	0.832
H6	0.992	-1.964	-0.832
H7	-0.992	1.964	0.832
H8	-0.992	1.964	-0.832
H9	-1.057	-0.678	-0.882
H10	-1.057	-0.678	0.882
H11	1.057	0.678	-0.882
H12	1.057	0.678	0.882

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5514	1.4850	2.5560	2.8127	2.8127	2.0883	2.0883	2.1716	2.1716	1.0940	1.0940
C2	1.5514		2.5560	1.4850	2.0883	2.0883	2.8127	2.8127	1.0940	1.0940	2.1716	2.1716
N3	1.4850	2.5560		3.8821	4.1914	4.1914	1.0178	1.0178	2.7984	2.7984	2.1008	2.1008
N4	2.5560	1.4850	3.8821		1.0178	1.0178	4.1914	4.1914	2.1008	2.1008	2.7984	2.7984
H5	2.8127	2.0883	4.1914	1.0178		1.6645	4.4008	4.7051	2.9643	2.4190	3.1507	2.6440
H6	2.8127	2.0883	4.1914	1.0178	1.6645		4.7051	4.4008	2.4190	2.9643	2.6440	3.1507
H7	2.0883	2.8127	1.0178	4.1914	4.4008	4.7051		1.6645	3.1507	2.6440	2.9643	2.4190
H8	2.0883	2.8127	1.0178	4.1914	4.7051	4.4008	1.6645		2.6440	3.1507	2.4190	2.9643
H9	2.1716	1.0940	2.7984	2.1008	2.9643	2.4190	3.1507	2.6440		1.7638	2.5115	3.0690
H10	2.1716	1.0940	2.7984	2.1008	2.4190	2.9643	2.6440	3.1507	1.7638		3.0690	2.5115
H11	1.0940	2.1716	2.1008	2.7984	3.1507	2.6440	2.9643	2.4190	2.5115	3.0690		1.7638
H12	1.0940	2.1716	2.1008	2.7984	2.6440	3.1507	2.4190	2.9643	3.0690	2.5115	1.7638

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	114.642	C1	C2	H9	109.129
C1	C2	H10	109.129	C1	N3	H7	111.737
C1	N3	H8	111.737	C2	C1	N3	114.642
C2	C1	H11	109.129	C2	C1	H12	109.129
C2	N4	H5	111.737	C2	N4	H6	111.737
N3	C1	H11	108.131	N3	C1	H12	108.131
N4	C2	H9	108.131	N4	C2	H10	108.131
H5	N4	H6	109.711	H7	N3	H8	109.711
H9	C2	H10	107.441	H11	C1	H12	107.441

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: CISD/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 C2H8N2 (Ethylenediamine)

using model chemistry: CISD/3-21G

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)