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	hartrees
Energy at 0K	-150.480068
Energy at 298.15K	-150.488009
HF Energy	-150.174126
Nuclear repulsion energy	82.478039

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3607	3373	0.33
2	A₁	3123	2921	45.43
3	A₁	1780	1665	54.00
4	A₁	1564	1462	0.80
5	A₁	1104	1033	86.81
6	A₁	776	726	70.24
7	A₁	469	438	0.00
8	A₂	3720	3479	0.00
9	A₂	1445	1351	0.00
10	A₂	1096	1025	0.00
11	A₂	269	252	0.00
12	B₁	3720	3479	0.49
13	B₁	3173	2967	34.06
14	B₁	1415	1324	0.69
15	B₁	859	803	0.11
16	B₁	415	388	111.18
17	B₂	3605	3371	0.04
18	B₂	1770	1655	8.44
19	B₂	1457	1362	9.70
20	B₂	1117	1045	85.83
21	B₂	618	578	611.65

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.550
N2	0.000	1.264	-0.197
N3	0.000	-1.264	-0.197
H4	0.881	0.000	1.198
H5	-0.881	0.000	1.198
H6	0.838	1.444	-0.733
H7	-0.838	1.444	-0.733
H8	-0.838	-1.444	-0.733
H9	0.838	-1.444	-0.733

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4687	1.4687	1.0939	1.0939	2.1061	2.1061	2.1061	2.1061
N2	1.4687		2.5284	2.0791	2.0791	1.0111	1.0111	2.8853	2.8853
N3	1.4687	2.5284		2.0791	2.0791	2.8853	2.8853	1.0111	1.0111
H4	1.0939	2.0791	2.0791		1.7626	2.4122	2.9620	2.9620	2.4122
H5	1.0939	2.0791	2.0791	1.7626		2.9620	2.4122	2.4122	2.9620
H6	2.1061	1.0111	2.8853	2.4122	2.9620		1.6766	3.3395	2.8882
H7	2.1061	1.0111	2.8853	2.9620	2.4122	1.6766		2.8882	3.3395
H8	2.1061	2.8853	1.0111	2.9620	2.4122	3.3395	2.8882		1.6766
H9	2.1061	2.8853	1.0111	2.4122	2.9620	2.8882	3.3395	1.6766

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	115.020	C1	N2	H7	115.020
C1	N3	H8	115.020	C1	N3	H9	115.020
N2	C1	N3	118.806	N2	C1	H4	107.551
N2	C1	H5	107.551	N3	C1	H4	107.551
N3	C1	H5	107.551	H4	C1	H5	107.339
H6	N2	H7	112.006	H8	N3	H9	112.006

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: CID/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 NH2CH2NH2 (diaminomethane)

using model chemistry: CID/6-31G

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)