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	hartrees
Energy at 0K	-150.964686
Energy at 298.15K	-150.972738
HF Energy	-150.305893
Counterpoise corrected energy	-150.964686
CP Energy at 298.15K	-150.972738
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.681638

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3546	3366	0.05
2	A₁	3124	2966	32.33
3	A₁	1672	1587	42.52
4	A₁	1517	1441	0.05
5	A₁	1123	1066	34.44
6	A₁	870	826	1.13
7	A₁	464	441	3.90
8	A₂	3643	3459	0.00
9	A₂	1418	1347	0.00
10	A₂	1083	1028	0.00
11	A₂	270	256	0.00
12	B₁	3640	3455	3.71
13	B₁	3159	2999	20.56
14	B₁	1383	1313	0.61
15	B₁	859	816	0.56
16	B₁	405	384	85.20
17	B₂	3547	3367	2.46
18	B₂	1659	1576	4.30
19	B₂	1402	1331	17.63
20	B₂	1120	1064	72.47
21	B₂	803	763	407.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.552
N2	0.000	1.252	-0.183
N3	0.000	-1.252	-0.183
H4	0.872	0.000	1.196
H5	-0.872	0.000	1.196
H6	0.810	1.303	-0.784
H7	-0.810	1.303	-0.784
H8	-0.810	-1.303	-0.784
H9	0.810	-1.303	-0.784

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4514	1.4514	1.0842	1.0842	2.0342	2.0342	2.0342	2.0342
N2	1.4514		2.5033	2.0565	2.0565	1.0100	1.0100	2.7467	2.7467
N3	1.4514	2.5033		2.0565	2.0565	2.7467	2.7467	1.0100	1.0100
H4	1.0842	2.0565	2.0565		1.7439	2.3709	2.9065	2.9065	2.3709
H5	1.0842	2.0565	2.0565	1.7439		2.9065	2.3709	2.3709	2.9065
H6	2.0342	1.0100	2.7467	2.3709	2.9065		1.6209	3.0693	2.6063
H7	2.0342	1.0100	2.7467	2.9065	2.3709	1.6209		2.6063	3.0693
H8	2.0342	2.7467	1.0100	2.9065	2.3709	3.0693	2.6063		1.6209
H9	2.0342	2.7467	1.0100	2.3709	2.9065	2.6063	3.0693	1.6209

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.179	C1	N2	H7	110.179
C1	N3	H8	110.179	C1	N3	H9	110.179
N2	C1	N3	119.168	N2	C1	H4	107.513
N2	C1	H5	107.513	N3	C1	H4	107.513
N3	C1	H5	107.513	H4	C1	H5	107.064
H6	N2	H7	106.731	H8	N3	H9	106.731

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2=FULL/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)