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	hartrees
Energy at 0K	-150.707909
Energy at 298.15K	-150.716030
HF Energy	-150.235778
Counterpoise corrected energy	-150.707909
CP Energy at 298.15K	-150.716030
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.116843

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3510	3307	0.56
2	A₁	3136	2955	35.23
3	A₁	1731	1631	51.45
4	A₁	1553	1463	0.20
5	A₁	1156	1089	37.72
6	A₁	910	858	0.10
7	A₁	468	441	7.11
8	A₂	3616	3407	0.00
9	A₂	1437	1354	0.00
10	A₂	1101	1037	0.00
11	A₂	298	281	0.00
12	B₁	3614	3405	0.11
13	B₁	3197	3012	25.58
14	B₁	1416	1335	0.34
15	B₁	873	823	0.60
16	B₁	427	402	115.03
17	B₂	3512	3309	0.04
18	B₂	1720	1621	1.60
19	B₂	1430	1347	21.31
20	B₂	1129	1064	60.86
21	B₂	851	802	464.19

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.554
N2	0.000	1.260	-0.183
N3	0.000	-1.260	-0.183
H4	0.880	0.000	1.202
H5	-0.880	0.000	1.202
H6	0.817	1.308	-0.791
H7	-0.817	1.308	-0.791
H8	-0.817	-1.308	-0.791
H9	0.817	-1.308	-0.791

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4603	1.4603	1.0928	1.0928	2.0460	2.0460	2.0460	2.0460
N2	1.4603		2.5209	2.0693	2.0693	1.0189	1.0189	2.7625	2.7625
N3	1.4603	2.5209		2.0693	2.0693	2.7625	2.7625	1.0189	1.0189
H4	1.0928	2.0693	2.0693		1.7607	2.3841	2.9257	2.9257	2.3841
H5	1.0928	2.0693	2.0693	1.7607		2.9257	2.3841	2.3841	2.9257
H6	2.0460	1.0189	2.7625	2.3841	2.9257		1.6333	3.0836	2.6155
H7	2.0460	1.0189	2.7625	2.9257	2.3841	1.6333		2.6155	3.0836
H8	2.0460	2.7625	1.0189	2.9257	2.3841	3.0836	2.6155		1.6333
H9	2.0460	2.7625	1.0189	2.3841	2.9257	2.6155	3.0836	1.6333

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.947	C1	N2	H7	109.947
C1	N3	H8	109.947	C1	N3	H9	109.947
N2	C1	N3	119.333	N2	C1	H4	107.410
N2	C1	H5	107.410	N3	C1	H4	107.410
N3	C1	H5	107.410	H4	C1	H5	107.336
H6	N2	H7	106.552	H8	N3	H9	106.552

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)