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	hartrees
Energy at 0K	-150.764025
Energy at 298.15K	-150.772141
HF Energy	-150.253946
Counterpoise corrected energy	-150.764025
CP Energy at 298.15K	-150.772141
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.349891

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3571	3337	0.76
2	A₁	3157	2950	38.65
3	A₁	1709	1597	43.48
4	A₁	1549	1447	0.00
5	A₁	1147	1072	36.56
6	A₁	901	842	0.29
7	A₁	467	436	6.91
8	A₂	3680	3438	0.00
9	A₂	1438	1344	0.00
10	A₂	1096	1024	0.00
11	A₂	294	275	0.00
12	B₁	3677	3436	0.04
13	B₁	3221	3010	27.30
14	B₁	1409	1317	0.34
15	B₁	869	812	0.99
16	B₁	426	398	107.00
17	B₂	3572	3338	0.04
18	B₂	1700	1588	2.19
19	B₂	1432	1338	23.95
20	B₂	1130	1056	62.11
21	B₂	835	780	436.31

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.553
N2	0.000	1.258	-0.183
N3	0.000	-1.258	-0.183
H4	0.877	0.000	1.198
H5	-0.877	0.000	1.198
H6	0.812	1.303	-0.788
H7	-0.812	1.303	-0.788
H8	-0.812	-1.303	-0.788
H9	0.812	-1.303	-0.788

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4581	1.4581	1.0884	1.0884	2.0387	2.0387	2.0387	2.0387
N2	1.4581		2.5169	2.0640	2.0640	1.0136	1.0136	2.7544	2.7544
N3	1.4581	2.5169		2.0640	2.0640	2.7544	2.7544	1.0136	1.0136
H4	1.0884	2.0640	2.0640		1.7539	2.3762	2.9146	2.9146	2.3762
H5	1.0884	2.0640	2.0640	1.7539		2.9146	2.3762	2.3762	2.9146
H6	2.0387	1.0136	2.7544	2.3762	2.9146		1.6241	3.0707	2.6061
H7	2.0387	1.0136	2.7544	2.9146	2.3762	1.6241		2.6061	3.0707
H8	2.0387	2.7544	1.0136	2.9146	2.3762	3.0707	2.6061		1.6241
H9	2.0387	2.7544	1.0136	2.3762	2.9146	2.6061	3.0707	1.6241

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.840	C1	N2	H7	109.840
C1	N3	H8	109.840	C1	N3	H9	109.840
N2	C1	N3	119.336	N2	C1	H4	107.405
N2	C1	H5	107.405	N3	C1	H4	107.405
N3	C1	H5	107.405	H4	C1	H5	107.359
H6	N2	H7	106.478	H8	N3	H9	106.478

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)