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	hartrees
Energy at 0K	-205.997535
Energy at 298.15K	-206.007797
HF Energy	-205.289769
Nuclear repulsion energy	137.768215

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3628	3415	1.01
2	A	3528	3321	6.12
3	A	3128	2945	38.14
4	A	1694	1595	48.73
5	A	1405	1322	1.36
6	A	983	926	10.71
7	A	898	846	1.23
8	A	565	531	24.23
9	A	314	296	79.72
10	E	3628	3415	0.03
10	E	3628	3415	0.03
11	E	3531	3324	0.10
11	E	3531	3324	0.10
12	E	1706	1606	22.92
12	E	1706	1606	22.92
13	E	1465	1379	30.47
13	E	1465	1379	30.47
14	E	1260	1186	60.00
14	E	1260	1186	60.00
15	E	1087	1023	37.71
15	E	1087	1023	37.71
16	E	958	902	221.51
16	E	958	902	221.51
17	E	452	425	39.65
17	E	452	425	39.65
18	E	299	282	19.93
18	E	299	282	19.93

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.369
H2	0.000	0.000	1.462
N3	0.000	1.397	-0.056
N4	1.210	-0.698	-0.056
N5	-1.210	-0.698	-0.056
H6	0.874	1.821	0.241
H7	1.140	-1.668	0.241
H8	-2.014	-0.154	0.241
H9	0.006	1.429	-1.073
H10	1.234	-0.720	-1.073
H11	-1.241	-0.709	-1.073

	C1	H2	N3	N4	N5	H6	H7	H8	H9	H10	H11
C1		1.0927	1.4600	1.4600	1.4600	2.0243	2.0243	2.0243	2.0302	2.0302	2.0302
H2	1.0927		2.0626	2.0626	2.0626	2.3603	2.3603	2.3603	2.9100	2.9100	2.9100
N3	1.4600	2.0626		2.4193	2.4193	1.0162	3.2832	2.5593	1.0178	2.6531	2.6473
N4	1.4600	2.0626	2.4193		2.4193	2.5593	1.0162	3.2832	2.6473	1.0178	2.6531
N5	1.4600	2.0626	2.4193	2.4193		3.2832	2.5593	1.0162	2.6531	2.6473	1.0178
H6	2.0243	2.3603	1.0162	2.5593	3.2832		3.4992	3.4992	1.6232	2.8837	3.5500
H7	2.0243	2.3603	3.2832	1.0162	2.5593	3.4992		3.4992	3.5500	1.6232	2.8837
H8	2.0243	2.3603	2.5593	3.2832	1.0162	3.4992	3.4992		2.8837	3.5500	1.6232
H9	2.0302	2.9100	1.0178	2.6473	2.6531	1.6232	3.5500	2.8837		2.4750	2.4750
H10	2.0302	2.9100	2.6531	1.0178	2.6473	2.8837	1.6232	3.5500	2.4750		2.4750
H11	2.0302	2.9100	2.6473	2.6531	1.0178	3.5500	2.8837	1.6232	2.4750	2.4750

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N3	H6	108.338	C1	N3	H9	108.729
C1	N4	H7	108.338	C1	N4	H10	108.729
C1	N5	H8	108.338	C1	N5	H11	108.729
H2	C1	N3	106.922	H2	C1	N4	106.922
H2	C1	N5	106.922	N3	C1	N4	111.896
N3	C1	N5	111.896	N4	C1	N5	111.896
H6	N3	H9	105.885	H7	N4	H10	105.885
H8	N5	H11	105.885

All results from a given calculation for CH₇N₃ (triaminomethane)

using model chemistry: QCISD/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 CH7N3 (triaminomethane)

using model chemistry: QCISD/6-31G**

States and conformations

All results from a given calculation for CH₇N₃ (triaminomethane)