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	hartrees
Energy at 0K	-204.566763
Energy at 298.15K	-204.576832
HF Energy	-204.121683
Nuclear repulsion energy	135.388343

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3466	3316	6.56
2	A	3361	3215	15.87
3	A	3085	2951	28.88
4	A	1742	1666	41.59
5	A	1398	1337	1.51
6	A	953	912	15.90
7	A	812	777	0.12
8	A	535	512	34.79
9	A	314	300	85.97
10	E	3466	3315	1.17
10	E	3466	3315	1.17
11	E	3363	3217	1.97
11	E	3363	3217	1.97
12	E	1745	1670	14.41
12	E	1745	1670	14.41
13	E	1445	1382	15.58
13	E	1445	1382	15.58
14	E	1238	1185	39.82
14	E	1238	1185	39.82
15	E	1060	1014	39.95
15	E	1060	1014	39.95
16	E	852	815	288.74
16	E	852	815	288.74
17	E	425	406	50.05
17	E	425	406	50.05
18	E	287	274	28.92
18	E	287	274	28.92

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.377
H2	0.000	0.000	1.473
N3	0.000	1.421	-0.061
N4	1.231	-0.711	-0.061
N5	-1.231	-0.711	-0.061
H6	0.857	1.881	0.268
H7	1.200	-1.683	0.268
H8	-2.058	-0.198	0.268
H9	-0.027	1.473	-1.088
H10	1.290	-0.713	-1.088
H11	-1.262	-0.760	-1.088

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0959	1.4869	1.4869	1.4869	2.0700	2.0700	2.0700	2.0781	2.0781	2.0781
H2	1.0959		2.0906	2.0906	2.0906	2.3928	2.3928	2.3928	2.9548	2.9548	2.9548
N3	1.4869	2.0906		2.4614	2.4614	1.0267	3.3442	2.6388	1.0294	2.6970	2.7217
N4	1.4869	2.0906	2.4614		2.4614	2.6388	1.0267	3.3442	2.7217	1.0294	2.6970
N5	1.4869	2.0906	2.4614	2.4614		3.3442	2.6388	1.0267	2.6970	2.7217	1.0294
H6	2.0700	2.3928	1.0267	2.6388	3.3442		3.5804	3.5804	1.6695	2.9589	3.6479
H7	2.0700	2.3928	3.3442	1.0267	2.6388	3.5804		3.5804	3.6479	1.6695	2.9589
H8	2.0700	2.3928	2.6388	3.3442	1.0267	3.5804	3.5804		2.9589	3.6479	1.6695
H9	2.0781	2.9548	1.0294	2.7217	2.6970	1.6695	3.6479	2.9589		2.5523	2.5523
H10	2.0781	2.9548	2.6970	1.0294	2.7217	2.9589	1.6695	3.6479	2.5523		2.5523
H11	2.0781	2.9548	2.7217	2.6970	1.0294	3.6479	2.9589	1.6695	2.5523	2.5523

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	109.515	C1	N3	H9	110.012
C1	N4	H7	109.515	C1	N4	H10	110.012
C1	N5	H8	109.515	C1	N5	H11	110.012
H2	C1	N3	107.111	H2	C1	N4	107.111
H2	C1	N5	107.111	N3	C1	N4	111.724
N3	C1	N5	111.724	N4	C1	N5	111.724
H6	N3	H9	108.575	H7	N4	H10	108.575
H8	N5	H11	108.575

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: CCD/3-21G*

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: CCD/3-21G*

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)