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	hartrees
Energy at 0K	-205.976948
Energy at 298.15K	-205.987219
HF Energy	-205.317479
Nuclear repulsion energy	137.945526

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3620	3440	0.00
2	A	3515	3340	5.34
3	A	3116	2961	33.20
4	A	1720	1634	71.75
5	A	1405	1335	1.41
6	A	983	934	16.72
7	A	901	856	0.20
8	A	568	539	23.13
9	A	326	310	74.69
10	E	3621	3441	0.49
10	E	3621	3441	0.49
11	E	3519	3344	0.09
11	E	3519	3344	0.09
12	E	1731	1645	34.68
12	E	1731	1645	34.68
13	E	1450	1378	25.93
13	E	1450	1378	25.93
14	E	1263	1200	57.93
14	E	1263	1200	57.93
15	E	1081	1027	50.42
15	E	1081	1027	50.42
16	E	953	906	252.28
16	E	953	906	252.28
17	E	451	429	42.95
17	E	451	429	42.95
18	E	295	281	24.39
18	E	295	281	24.39

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.368
H2	0.000	0.000	1.463
N3	0.000	1.394	-0.055
N4	1.207	-0.697	-0.055
N5	-1.207	-0.697	-0.055
H6	0.877	1.820	0.228
H7	1.138	-1.669	0.228
H8	-2.015	-0.151	0.228
H9	-0.045	1.436	-1.069
H10	1.266	-0.679	-1.069
H11	-1.221	-0.757	-1.069

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0946	1.4570	1.4570	1.4570	2.0252	2.0252	2.0252	2.0321	2.0321	2.0321
H2	1.0946		2.0608	2.0608	2.0608	2.3681	2.3681	2.3681	2.9110	2.9110	2.9110
N3	1.4570	2.0608		2.4148	2.4148	1.0149	3.2803	2.5544	1.0160	2.6324	2.6734
N4	1.4570	2.0608	2.4148		2.4148	2.5544	1.0149	3.2803	2.6734	1.0160	2.6324
N5	1.4570	2.0608	2.4148	2.4148		3.2803	2.5544	1.0149	2.6324	2.6734	1.0160
H6	2.0252	2.3681	1.0149	2.5544	3.2803		3.4993	3.4993	1.6365	2.8421	3.5669
H7	2.0252	2.3681	3.2803	1.0149	2.5544	3.4993		3.4993	3.5669	1.6365	2.8421
H8	2.0252	2.3681	2.5544	3.2803	1.0149	3.4993	3.4993		2.8421	3.5669	1.6365
H9	2.0321	2.9110	1.0160	2.6734	2.6324	1.6365	3.5669	2.8421		2.4883	2.4883
H10	2.0321	2.9110	2.6324	1.0160	2.6734	2.8421	1.6365	3.5669	2.4883		2.4883
H11	2.0321	2.9110	2.6734	2.6324	1.0160	3.5669	2.8421	1.6365	2.4883	2.4883

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	108.713	C1	N3	H9	109.214
C1	N4	H7	108.713	C1	N4	H10	109.214
C1	N5	H8	108.713	C1	N5	H11	109.214
H2	C1	N3	106.878	H2	C1	N4	106.878
H2	C1	N5	106.878	N3	C1	N4	111.935
N3	C1	N5	111.935	N4	C1	N5	111.935
H6	N3	H9	107.376	H7	N4	H10	107.376
H8	N5	H11	107.376

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: MP2/6-311G*

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 CH7N3 (triaminomethane)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)