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	hartrees
Energy at 0K	-150.787794
Energy at 298.15K	-150.795908
HF Energy	-150.256099
Nuclear repulsion energy	82.868311

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3482	3298	4.30
2	A₁	3080	2918	45.85
3	A₁	1674	1586	30.81
4	A₁	1496	1417	0.02
5	A₁	1151	1090	26.30
6	A₁	920	872	0.81
7	A₁	459	435	8.10
8	A₂	3566	3378	0.00
9	A₂	1414	1340	0.00
10	A₂	1094	1037	0.00
11	A₂	285	270	0.00
12	B₁	3564	3376	1.68
13	B₁	3131	2966	32.73
14	B₁	1395	1322	1.32
15	B₁	865	819	1.72
16	B₁	415	393	90.32
17	B₂	3482	3298	0.01
18	B₂	1669	1581	1.18
19	B₂	1405	1331	33.58
20	B₂	1131	1071	59.55
21	B₂	883	836	343.56

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.560
N2	0.000	1.263	-0.183
N3	0.000	-1.263	-0.183
H4	0.888	0.000	1.217
H5	-0.888	0.000	1.217
H6	0.812	1.275	-0.808
H7	-0.812	1.275	-0.808
H8	-0.812	-1.275	-0.808
H9	0.812	-1.275	-0.808

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4653	1.4653	1.1049	1.1049	2.0388	2.0388	2.0388	2.0388
N2	1.4653		2.5264	2.0843	2.0843	1.0253	1.0253	2.7373	2.7373
N3	1.4653	2.5264		2.0843	2.0843	2.7373	2.7373	1.0253	1.0253
H4	1.1049	2.0843	2.0843		1.7759	2.3945	2.9358	2.9358	2.3945
H5	1.1049	2.0843	2.0843	1.7759		2.9358	2.3945	2.3945	2.9358
H6	2.0388	1.0253	2.7373	2.3945	2.9358		1.6247	3.0233	2.5496
H7	2.0388	1.0253	2.7373	2.9358	2.3945	1.6247		2.5496	3.0233
H8	2.0388	2.7373	1.0253	2.9358	2.3945	3.0233	2.5496		1.6247
H9	2.0388	2.7373	1.0253	2.3945	2.9358	2.5496	3.0233	1.6247

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	108.595	C1	N2	H7	108.595
C1	N3	H8	108.595	C1	N3	H9	108.595
N2	C1	N3	119.105	N2	C1	H4	107.551
N2	C1	H5	107.551	N3	C1	H4	107.551
N3	C1	H5	107.551	H4	C1	H5	106.963
H6	N2	H7	104.803	H8	N3	H9	104.803

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: CCSD/cc-pVDZ

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: CCSD/cc-pVDZ

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)