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	hartrees
Energy at 0K	-150.481322
Energy at 298.15K	-150.489261
HF Energy	-150.174032
Nuclear repulsion energy	82.438443

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3598	3374	0.40
2	A₁	3118	2924	45.79
3	A₁	1777	1666	53.05
4	A₁	1562	1465	0.76
5	A₁	1101	1032	86.91
6	A₁	774	726	68.06
7	A₁	467	438	0.01
8	A₂	3710	3480	0.00
9	A₂	1443	1353	0.00
10	A₂	1094	1026	0.00
11	A₂	270	253	0.00
12	B₁	3710	3480	0.36
13	B₁	3168	2971	34.44
14	B₁	1413	1325	0.64
15	B₁	858	804	0.10
16	B₁	416	390	110.91
17	B₂	3596	3372	0.02
18	B₂	1766	1657	7.96
19	B₂	1454	1364	9.77
20	B₂	1110	1041	86.54
21	B₂	617	579	613.90

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.551
N2	0.000	1.265	-0.197
N3	0.000	-1.265	-0.197
H4	0.882	0.000	1.198
H5	-0.882	0.000	1.198
H6	0.838	1.444	-0.734
H7	-0.838	1.444	-0.734
H8	-0.838	-1.444	-0.734
H9	0.838	-1.444	-0.734

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4696	1.4696	1.0940	1.0940	2.1068	2.1068	2.1068	2.1068
N2	1.4696		2.5303	2.0798	2.0798	1.0115	1.0115	2.8864	2.8864
N3	1.4696	2.5303		2.0798	2.0798	2.8864	2.8864	1.0115	1.0115
H4	1.0940	2.0798	2.0798		1.7633	2.4127	2.9628	2.9628	2.4127
H5	1.0940	2.0798	2.0798	1.7633		2.9628	2.4127	2.4127	2.9628
H6	2.1068	1.0115	2.8864	2.4127	2.9628		1.6769	3.3398	2.8883
H7	2.1068	1.0115	2.8864	2.9628	2.4127	1.6769		2.8883	3.3398
H8	2.1068	2.8864	1.0115	2.9628	2.4127	3.3398	2.8883		1.6769
H9	2.1068	2.8864	1.0115	2.4127	2.9628	2.8883	3.3398	1.6769

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	114.985	C1	N2	H7	114.985
C1	N3	H8	114.985	C1	N3	H9	114.985
N2	C1	N3	118.821	N2	C1	H4	107.535
N2	C1	H5	107.535	N3	C1	H4	107.535
N3	C1	H5	107.535	H4	C1	H5	107.393
H6	N2	H7	111.979	H8	N3	H9	111.979

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: CISD/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: CISD/6-31G

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)