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	hartrees
Energy at 0K	-150.759179
Energy at 298.15K	-150.767299
HF Energy	-150.272510
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.181520

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3542	3366	2.06
2	A₁	3115	2960	38.39
3	A₁	1747	1660	70.95
4	A₁	1522	1446	0.81
5	A₁	1151	1094	39.50
6	A₁	913	868	0.54
7	A₁	467	444	5.40
8	A₂	3644	3463	0.00
9	A₂	1434	1363	0.00
10	A₂	1105	1050	0.00
11	A₂	285	271	0.00
12	B₁	3641	3460	0.00
13	B₁	3174	3016	28.01
14	B₁	1417	1346	0.69
15	B₁	866	823	0.87
16	B₁	428	407	108.01
17	B₂	3543	3367	0.11
18	B₂	1736	1649	1.66
19	B₂	1422	1351	21.62
20	B₂	1121	1065	69.77
21	B₂	853	810	490.87

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.535
N2	0.000	1.286	-0.179
N3	0.000	-1.286	-0.179
H4	0.882	0.000	1.176
H5	-0.882	0.000	1.176
H6	0.819	1.361	-0.766
H7	-0.819	1.361	-0.766
H8	-0.819	-1.361	-0.766
H9	0.819	-1.361	-0.766

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4708	1.4708	1.0904	1.0904	2.0533	2.0533	2.0533	2.0533
N2	1.4708		2.5720	2.0658	2.0658	1.0107	1.0107	2.8324	2.8324
N3	1.4708	2.5720		2.0658	2.0658	2.8324	2.8324	1.0107	1.0107
H4	1.0904	2.0658	2.0658		1.7638	2.3727	2.9187	2.9187	2.3727
H5	1.0904	2.0658	2.0658	1.7638		2.9187	2.3727	2.3727	2.9187
H6	2.0533	1.0107	2.8324	2.3727	2.9187		1.6380	3.1768	2.7219
H7	2.0533	1.0107	2.8324	2.9187	2.3727	1.6380		2.7219	3.1768
H8	2.0533	2.8324	1.0107	2.9187	2.3727	3.1768	2.7219		1.6380
H9	2.0533	2.8324	1.0107	2.3727	2.9187	2.7219	3.1768	1.6380

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.297	C1	N2	H7	110.297
C1	N3	H8	110.297	C1	N3	H9	110.297
N2	C1	N3	121.943	N2	C1	H4	106.583
N2	C1	H5	106.583	N3	C1	H4	106.583
N3	C1	H5	106.583	H4	C1	H5	107.948
H6	N2	H7	108.256	H8	N3	H9	108.256

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2/6-311G*

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: MP2/6-311G*

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)