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	hartrees
Energy at 0K	-189.629755
Energy at 298.15K	-189.639878
HF Energy	-189.184268
Nuclear repulsion energy	129.867482

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3515	3373	0.00
2	A_g	3007	2885	0.00
3	A_g	1746	1675	0.00
4	A_g	1535	1472	0.00
5	A_g	1430	1372	0.00
6	A_g	1126	1080	0.00
7	A_g	1047	1004	0.00
8	A_g	716	687	0.00
9	A_g	469	450	0.00
10	A_u	3626	3479	0.00
11	A_u	3068	2944	77.74
12	A_u	1410	1353	0.46
13	A_u	1085	1041	0.04
14	A_u	758	727	0.37
15	A_u	267	256	135.76
16	A_u	151	145	0.06
17	B_g	3626	3480	0.00
18	B_g	3041	2918	0.00
19	B_g	1388	1332	0.00
20	B_g	1336	1282	0.00
21	B_g	952	914	0.00
22	B_g	293	281	0.00
23	B_u	3515	3372	0.98
24	B_u	3013	2891	85.35
25	B_u	1746	1676	55.92
26	B_u	1552	1489	1.46
27	B_u	1365	1310	9.81
28	B_u	1095	1051	15.52
29	B_u	735	705	635.87
30	B_u	277	266	24.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.405	0.664	0.000
C2	-0.405	-0.664	0.000
N3	-0.405	1.902	0.000
N4	0.405	-1.902	0.000
H5	0.967	-2.027	0.840
H6	0.967	-2.027	-0.840
H7	-0.967	2.027	0.840
H8	-0.967	2.027	-0.840
H9	-1.064	-0.686	-0.886
H10	-1.064	-0.686	0.886
H11	1.064	0.686	-0.886
H12	1.064	0.686	0.886

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10	H11	H12
C1		1.5556	1.4793	2.5657	2.8740	2.8740	2.1079	2.1079	2.1833	2.1833	1.1047	1.1047
C2	1.5556		2.5657	1.4793	2.1079	2.1079	2.8740	2.8740	1.1047	1.1047	2.1833	2.1833
N3	1.4793	2.5657		3.8887	4.2448	4.2448	1.0179	1.0179	2.8136	2.8136	2.1029	2.1029
N4	2.5657	1.4793	3.8887		1.0179	1.0179	4.2448	4.2448	2.1029	2.1029	2.8136	2.8136
H5	2.8740	2.1079	4.2448	1.0179		1.6795	4.4906	4.7944	2.9833	2.4338	3.2167	2.7149
H6	2.8740	2.1079	4.2448	1.0179	1.6795		4.7944	4.4906	2.4338	2.9833	2.7149	3.2167
H7	2.1079	2.8740	1.0179	4.2448	4.4906	4.7944		1.6795	3.2167	2.7149	2.9833	2.4338
H8	2.1079	2.8740	1.0179	4.2448	4.7944	4.4906	1.6795		2.7149	3.2167	2.4338	2.9833
H9	2.1833	1.1047	2.8136	2.1029	2.9833	2.4338	3.2167	2.7149		1.7722	2.5326	3.0911
H10	2.1833	1.1047	2.8136	2.1029	2.4338	2.9833	2.7149	3.2167	1.7722		3.0911	2.5326
H11	1.1047	2.1833	2.1029	2.8136	3.2167	2.7149	2.9833	2.4338	2.5326	3.0911		1.7722
H12	1.1047	2.1833	2.1029	2.8136	2.7149	3.2167	2.4338	2.9833	3.0911	2.5326	1.7722

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	115.409	C1	C2	H9	109.138
C1	C2	H10	109.138	C1	N3	H7	113.878
C1	N3	H8	113.878	C2	C1	N3	115.409
C2	C1	H11	109.138	C2	C1	H12	109.138
C2	N4	H5	113.878	C2	N4	H6	113.878
N3	C1	H11	108.067	N3	C1	H12	108.067
N4	C2	H9	108.067	N4	C2	H10	108.067
H5	N4	H6	111.183	H7	N3	H8	111.183
H9	C2	H10	106.672	H11	C1	H12	106.672

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)

using model chemistry: CCD/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: CCD/6-31G

States and conformations

All results from a given calculation for C₂H₈N₂ (Ethylenediamine)