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	hartrees
Energy at 0K	-149.707035
Energy at 298.15K	-149.715051
HF Energy	-149.400651
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	81.760800

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3425	3258	5.43
2	A₁	3119	2967	35.27
3	A₁	1767	1681	32.52
4	A₁	1571	1494	0.77
5	A₁	1101	1047	56.82
6	A₁	785	747	4.82
7	A₁	445	424	5.99
8	A₂	3530	3359	0.00
9	A₂	1447	1377	0.00
10	A₂	1104	1050	0.00
11	A₂	301	287	0.00
12	B₁	3530	3359	3.14
13	B₁	3173	3018	26.72
14	B₁	1405	1336	0.32
15	B₁	847	806	0.10
16	B₁	441	419	121.18
17	B₂	3426	3260	0.48
18	B₂	1754	1668	0.28
19	B₂	1435	1365	6.79
20	B₂	1049	998	12.01
21	B₂	700	666	561.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.560
N2	0.000	1.287	-0.191
N3	0.000	-1.287	-0.191
H4	0.885	0.000	1.200
H5	-0.885	0.000	1.200
H6	0.836	1.383	-0.774
H7	-0.836	1.383	-0.774
H8	-0.836	-1.383	-0.774
H9	0.836	-1.383	-0.774

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4900	1.4900	1.0924	1.0924	2.0955	2.0955	2.0955	2.0955
N2	1.4900		2.5737	2.0916	2.0916	1.0236	1.0236	2.8576	2.8576
N3	1.4900	2.5737		2.0916	2.0916	2.8576	2.8576	1.0236	1.0236
H4	1.0924	2.0916	2.0916		1.7707	2.4109	2.9618	2.9618	2.4109
H5	1.0924	2.0916	2.0916	1.7707		2.9618	2.4109	2.4109	2.9618
H6	2.0955	1.0236	2.8576	2.4109	2.9618		1.6713	3.2315	2.7657
H7	2.0955	1.0236	2.8576	2.9618	2.4109	1.6713		2.7657	3.2315
H8	2.0955	2.8576	1.0236	2.9618	2.4109	3.2315	2.7657		1.6713
H9	2.0955	2.8576	1.0236	2.4109	2.9618	2.7657	3.2315	1.6713

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	111.607	C1	N2	H7	111.607
C1	N3	H8	111.607	C1	N3	H9	111.607
N2	C1	N3	119.463	N2	C1	H4	107.174
N2	C1	H5	107.174	N3	C1	H4	107.174
N3	C1	H5	107.174	H4	C1	H5	108.279
H6	N2	H7	109.447	H8	N3	H9	109.447

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2/3-21G*

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 NH2CH2NH2 (diaminomethane)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)