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	hartrees
Energy at 0K	-188.597061
Energy at 298.15K	-188.607307
Nuclear repulsion energy	130.378129

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3509	3265	0.00
2	A_g	3109	2893	0.00
3	A_g	1789	1664	0.00
4	A_g	1589	1479	0.00
5	A_g	1456	1355	0.00
6	A_g	1130	1052	0.00
7	A_g	1036	964	0.00
8	A_g	781	727	0.00
9	A_g	470	437	0.00
10	A_u	3601	3351	0.92
11	A_u	3167	2947	62.37
12	A_u	1453	1352	2.69
13	A_u	1124	1046	0.12
14	A_u	778	724	0.60
15	A_u	286	266	139.55
16	A_u	153	142	0.56
17	B_g	3602	3351	0.00
18	B_g	3138	2920	0.00
19	B_g	1432	1332	0.00
20	B_g	1370	1275	0.00
21	B_g	976	909	0.00
22	B_g	311	289	0.00
23	B_u	3506	3262	2.14
24	B_u	3114	2898	69.65
25	B_u	1789	1664	42.16
26	B_u	1606	1494	1.76
27	B_u	1393	1296	7.43
28	B_u	1091	1015	10.75
29	B_u	803	747	542.31
30	B_u	274	255	20.54

Atom	x (Å)	y (Å)	z (Å)
C1	0.409	0.658	0.000
C2	-0.409	-0.658	0.000
N3	-0.409	1.896	0.000
N4	0.409	-1.896	0.000
H5	0.991	-1.964	0.832
H6	0.991	-1.964	-0.832
H7	-0.991	1.964	0.832
H8	-0.991	1.964	-0.832
H9	-1.056	-0.678	-0.882
H10	-1.056	-0.678	0.882
H11	1.056	0.678	-0.882
H12	1.056	0.678	0.882

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5504	1.4839	2.5543	2.8121	2.8121	2.0874	2.0874	2.1706	2.1706	1.0938	1.0938
C2	1.5504		2.5543	1.4839	2.0874	2.0874	2.8121	2.8121	1.0938	1.0938	2.1706	2.1706
N3	1.4839	2.5543		3.8794	4.1897	4.1897	1.0173	1.0173	2.7967	2.7967	2.0998	2.0998
N4	2.5543	1.4839	3.8794		1.0173	1.0173	4.1897	4.1897	2.0998	2.0998	2.7967	2.7967
H5	2.8121	2.0874	4.1897	1.0173		1.6641	4.3998	4.7040	2.9633	2.4181	3.1500	2.6436
H6	2.8121	2.0874	4.1897	1.0173	1.6641		4.7040	4.3998	2.4181	2.9633	2.6436	3.1500
H7	2.0874	2.8121	1.0173	4.1897	4.3998	4.7040		1.6641	3.1500	2.6436	2.9633	2.4181
H8	2.0874	2.8121	1.0173	4.1897	4.7040	4.3998	1.6641		2.6436	3.1500	2.4181	2.9633
H9	2.1706	1.0938	2.7967	2.0998	2.9633	2.4181	3.1500	2.6436		1.7631	2.5107	3.0679
H10	2.1706	1.0938	2.7967	2.0998	2.4181	2.9633	2.6436	3.1500	1.7631		3.0679	2.5107
H11	1.0938	2.1706	2.0998	2.7967	3.1500	2.6436	2.9633	2.4181	2.5107	3.0679		1.7631
H12	1.0938	2.1706	2.0998	2.7967	2.6436	3.1500	2.4181	2.9633	3.0679	2.5107	1.7631

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	114.649	C1	C2	H9	109.130
C1	C2	H10	109.130	C1	N3	H7	111.788
C1	N3	H8	111.788	C2	C1	N3	114.649
C2	C1	H11	109.130	C2	C1	H12	109.130
C2	N4	H5	111.788	C2	N4	H6	111.788
N3	C1	H11	108.143	N3	C1	H12	108.143
N4	C2	H9	108.143	N4	C2	H10	108.143
H5	N4	H6	109.753	H7	N3	H8	109.753
H9	C2	H10	107.408	H11	C1	H12	107.408

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

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

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)