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	hartrees
Energy at 0K	-188.649629
Energy at 298.15K	-188.659831
HF Energy	-188.211696
Nuclear repulsion energy	129.612171

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3387	3239	0.00
2	A_g	3030	2898	0.00
3	A_g	1754	1678	0.00
4	A_g	1554	1487	0.00
5	A_g	1420	1358	0.00
6	A_g	1115	1067	0.00
7	A_g	1006	963	0.00
8	A_g	792	758	0.00
9	A_g	457	437	0.00
10	A_u	3479	3328	6.45
11	A_u	3089	2955	57.86
12	A_u	1425	1363	3.83
13	A_u	1108	1059	0.37
14	A_u	761	728	0.42
15	A_u	288	275	139.35
16	A_u	149	143	0.43
17	B_g	3479	3328	0.00
18	B_g	3062	2929	0.00
19	B_g	1402	1341	0.00
20	B_g	1344	1286	0.00
21	B_g	959	918	0.00
22	B_g	314	300	0.00
23	B_u	3386	3239	7.08
24	B_u	3037	2905	63.84
25	B_u	1754	1678	36.06
26	B_u	1571	1503	1.77
27	B_u	1358	1299	7.23
28	B_u	1071	1024	21.69
29	B_u	819	783	464.83
30	B_u	265	254	20.63

Atom	x (Å)	y (Å)	z (Å)
C1	0.411	0.662	0.000
C2	-0.411	-0.662	0.000
N3	-0.411	1.910	0.000
N4	0.411	-1.910	0.000
H5	1.007	-1.951	0.834
H6	1.007	-1.951	-0.834
H7	-1.007	1.951	0.834
H8	-1.007	1.951	-0.834
H9	-1.061	-0.682	-0.888
H10	-1.061	-0.682	0.888
H11	1.061	0.682	-0.888
H12	1.061	0.682	0.888

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5578	1.4951	2.5718	2.8061	2.8061	2.0903	2.0903	2.1820	2.1820	1.1002	1.1002
C2	1.5578		2.5718	1.4951	2.0903	2.0903	2.8061	2.8061	1.1002	1.1002	2.1820	2.1820
N3	1.4951	2.5718		3.9079	4.1969	4.1969	1.0259	1.0259	2.8163	2.8163	2.1125	2.1125
N4	2.5718	1.4951	3.9079		1.0259	1.0259	4.1969	4.1969	2.1125	2.1125	2.8163	2.8163
H5	2.8061	2.0903	4.1969	1.0259		1.6678	4.3907	4.6968	2.9749	2.4268	3.1462	2.6340
H6	2.8061	2.0903	4.1969	1.0259	1.6678		4.6968	4.3907	2.4268	2.9749	2.6340	3.1462
H7	2.0903	2.8061	1.0259	4.1969	4.3907	4.6968		1.6678	3.1462	2.6340	2.9749	2.4268
H8	2.0903	2.8061	1.0259	4.1969	4.6968	4.3907	1.6678		2.6340	3.1462	2.4268	2.9749
H9	2.1820	1.1002	2.8163	2.1125	2.9749	2.4268	3.1462	2.6340		1.7752	2.5229	3.0849
H10	2.1820	1.1002	2.8163	2.1125	2.4268	2.9749	2.6340	3.1462	1.7752		3.0849	2.5229
H11	1.1002	2.1820	2.1125	2.8163	3.1462	2.6340	2.9749	2.4268	2.5229	3.0849		1.7752
H12	1.1002	2.1820	2.1125	2.8163	2.6340	3.1462	2.4268	2.9749	3.0849	2.5229	1.7752

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	114.771	C1	C2	H9	109.136
C1	C2	H10	109.136	C1	N3	H7	110.641
C1	N3	H8	110.641	C2	C1	N3	114.771
C2	C1	H11	109.136	C2	C1	H12	109.136
C2	N4	H5	110.641	C2	N4	H6	110.641
N3	C1	H11	108.004	N3	C1	H12	108.004
N4	C2	H9	108.004	N4	C2	H10	108.004
H5	N4	H6	108.751	H7	N3	H8	108.751
H9	C2	H10	107.555	H11	C1	H12	107.555

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: CCD/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: CCD/3-21G*

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)