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	hartrees
Energy at 0K	-94.583931
Energy at 298.15K	-94.586845
HF Energy	-94.583931
Nuclear repulsion energy	32.690454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3560	3426	23.08	70.02	0.69	0.81
2	A'	3370	3244	21.35	356.06	0.27	0.43
3	A'	2923	2813	127.55	157.19	0.63	0.78
4	A'	1710	1646	10.16	23.01	0.62	0.76
5	A'	1431	1377	27.87	16.17	0.32	0.48
6	A'	1391	1339	29.92	1.30	0.61	0.76
7	A'	1071	1030	24.68	8.49	0.57	0.72
8	A"	1159	1116	11.57	1.02	0.75	0.86
9	A"	819	788	185.30	0.16	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.793
N2	0.062	-0.526
H3	-1.008	1.090
H4	-0.753	-1.146
H5	0.949	-1.021

	C1	N2	H3	H4	H5
C1		1.3193	1.1108	2.1035	2.0195
N2	1.3193		1.9384	1.0244	1.0154
H3	1.1108	1.9384		2.2501	2.8787
H4	2.1035	1.0244	2.2501		1.7068
H5	2.0195	1.0154	2.8787	1.7068

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.214		C1	N2	H5	119.188
N2	C1	H3	105.496		H4	N2	H5	113.598

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: TPSSh/6-31+G**

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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Number	Element	Mulliken
1	C	-0.239
2	N	-0.460
3	H	0.083
4	H	0.288
5	H	0.328

	x	y	z	Total
	-1.460	-3.380	0.000	3.681
CHELPG
AIM
ESP

	x	y	z
x	3.307	0.039	0.000
y	0.039	4.589	0.000
z	0.000	0.000	2.389

<r²>	20.182
(<r²>)^1/2	4.492

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: TPSSh/6-31+G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)