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	hartrees
Energy at 0K	-28.579471
Energy at 298.15K	-28.587364
HF Energy	-28.266450
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	49.291681

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3459	3376	4.26
2	A₁	3036	2963	46.96
3	A₁	1727	1686	64.81
4	A₁	1492	1457	0.60
5	A₁	1067	1042	78.54
6	A₁	773	755	41.48
7	A₁	448	437	0.45
8	A₂	3600	3514	0.00
9	A₂	1393	1360	0.00
10	A₂	1060	1034	0.00
11	A₂	248	242	0.00
12	B₁	3600	3514	0.07
13	B₁	3115	3041	36.04
14	B₁	1375	1342	0.32
15	B₁	827	807	0.04
16	B₁	405	395	103.45
17	B₂	3461	3378	0.27
18	B₂	1715	1674	10.83
19	B₂	1414	1380	20.12
20	B₂	1054	1029	100.89
21	B₂	649	634	612.51

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.560
N2	0.000	1.291	-0.198
N3	0.000	-1.291	-0.198
H4	0.893	0.000	1.200
H5	-0.893	0.000	1.200
H6	0.846	1.451	-0.749
H7	-0.846	1.451	-0.749
H8	-0.846	-1.451	-0.749
H9	0.846	-1.451	-0.749

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4968	1.4968	1.0988	1.0988	2.1292	2.1292	2.1292	2.1292
N2	1.4968		2.5815	2.1017	2.1017	1.0219	1.0219	2.9217	2.9217
N3	1.4968	2.5815		2.1017	2.1017	2.9217	2.9217	1.0219	1.0219
H4	1.0988	2.1017	2.1017		1.7868	2.4299	2.9877	2.9877	2.4299
H5	1.0988	2.1017	2.1017	1.7868		2.9877	2.4299	2.4299	2.9877
H6	2.1292	1.0219	2.9217	2.4299	2.9877		1.6912	3.3589	2.9021
H7	2.1292	1.0219	2.9217	2.9877	2.4299	1.6912		2.9021	3.3589
H8	2.1292	2.9217	1.0219	2.9877	2.4299	3.3589	2.9021		1.6912
H9	2.1292	2.9217	1.0219	2.4299	2.9877	2.9021	3.3589	1.6912

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	114.094	C1	N2	H7	114.094
C1	N3	H8	114.094	C1	N3	H9	114.094
N2	C1	N3	119.169	N2	C1	H4	107.143
N2	C1	H5	107.143	N3	C1	H4	107.143
N3	C1	H5	107.143	H4	C1	H5	108.788
H6	N2	H7	111.673	H8	N3	H9	111.673

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2/CEP-121G

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/CEP-121G

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)