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	hartrees
Energy at 0K	-189.903181
Energy at 298.15K	-189.913504
HF Energy	-189.264381
Nuclear repulsion energy	131.285246

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3468	3303	0.00
2	A_g	3049	2903	0.00
3	A_g	1728	1646	0.00
4	A_g	1537	1463	0.00
5	A_g	1444	1375	0.00
6	A_g	1158	1103	0.00
7	A_g	1110	1057	0.00
8	A_g	901	858	0.00
9	A_g	470	448	0.00
10	A_u	3556	3386	1.08
11	A_u	3107	2959	72.37
12	A_u	1432	1363	2.25
13	A_u	1098	1046	0.53
14	A_u	770	734	0.19
15	A_u	285	271	128.27
16	A_u	153	146	0.16
17	B_g	3557	3387	0.00
18	B_g	3082	2935	0.00
19	B_g	1405	1338	0.00
20	B_g	1340	1276	0.00
21	B_g	969	922	0.00
22	B_g	318	303	0.00
23	B_u	3468	3303	2.66
24	B_u	3054	2908	80.63
25	B_u	1726	1644	51.60
26	B_u	1553	1479	0.85
27	B_u	1361	1296	27.58
28	B_u	1120	1066	5.75
29	B_u	949	903	410.84
30	B_u	281	268	20.96

Atom	x (Å)	y (Å)	z (Å)
C1	0.399	0.655	0.000
C2	-0.399	-0.655	0.000
N3	-0.399	1.887	0.000
N4	0.399	-1.887	0.000
H5	1.016	-1.889	0.814
H6	1.016	-1.889	-0.814
H7	-1.016	1.889	0.814
H8	-1.016	1.889	-0.814
H9	-1.058	-0.680	-0.881
H10	-1.058	-0.680	0.881
H11	1.058	0.680	-0.881
H12	1.058	0.680	0.881

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5349	1.4674	2.5420	2.7417	2.7417	2.0463	2.0463	2.1639	2.1639	1.1002	1.1002
C2	1.5349		2.5420	1.4674	2.0463	2.0463	2.7417	2.7417	1.1002	1.1002	2.1639	2.1639
N3	1.4674	2.5420		3.8566	4.1133	4.1133	1.0216	1.0216	2.7922	2.7922	2.0869	2.0869
N4	2.5420	1.4674	3.8566		1.0216	1.0216	4.1133	4.1133	2.0869	2.0869	2.7922	2.7922
H5	2.7417	2.0463	4.1133	1.0216		1.6290	4.2893	4.5883	2.9387	2.4013	3.0781	2.5700
H6	2.7417	2.0463	4.1133	1.0216	1.6290		4.5883	4.2893	2.4013	2.9387	2.5700	3.0781
H7	2.0463	2.7417	1.0216	4.1133	4.2893	4.5883		1.6290	3.0781	2.5700	2.9387	2.4013
H8	2.0463	2.7417	1.0216	4.1133	4.5883	4.2893	1.6290		2.5700	3.0781	2.4013	2.9387
H9	2.1639	1.1002	2.7922	2.0869	2.9387	2.4013	3.0781	2.5700		1.7618	2.5151	3.0707
H10	2.1639	1.1002	2.7922	2.0869	2.4013	2.9387	2.5700	3.0781	1.7618		3.0707	2.5151
H11	1.1002	2.1639	2.0869	2.7922	3.0781	2.5700	2.9387	2.4013	2.5151	3.0707		1.7618
H12	1.1002	2.1639	2.0869	2.7922	2.5700	3.0781	2.4013	2.9387	3.0707	2.5151	1.7618

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	115.684	C1	C2	H9	109.298
C1	C2	H10	109.298	C1	N3	H7	109.289
C1	N3	H8	109.289	C2	C1	N3	115.684
C2	C1	H11	109.298	C2	C1	H12	109.298
C2	N4	H5	109.289	C2	N4	H6	109.289
N3	C1	H11	107.883	N3	C1	H12	107.883
N4	C2	H9	107.883	N4	C2	H10	107.883
H5	N4	H6	105.745	H7	N3	H8	105.745
H9	C2	H10	106.393	H11	C1	H12	106.393

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: QCISD/6-31G*

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: QCISD/6-31G*

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)