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	hartrees
Energy at 0K	-94.468923
Energy at 298.15K	-94.471826
HF Energy	-94.468923
Nuclear repulsion energy	32.633111

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'	3441	3405	4.28	103.83	0.57	0.73
2	A'	3200	3167	95.13	523.49	0.33	0.50
3	A'	2820	2790	138.95	181.02	0.57	0.73
4	A'	1690	1672	3.11	38.26	0.42	0.60
5	A'	1422	1407	10.19	7.76	0.63	0.77
6	A'	1358	1344	15.48	2.27	0.75	0.86
7	A'	1058	1047	34.84	21.89	0.48	0.65
8	A"	1144	1132	13.25	1.08	0.75	0.86
9	A"	806	797	175.87	1.90	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.793
N2	0.063	-0.523
H3	-1.019	1.089
H4	-0.754	-1.158
H5	0.954	-1.024

	C1	N2	H3	H4	H5
C1		1.3158	1.1213	2.1149	2.0231
N2	1.3158		1.9410	1.0348	1.0219
H3	1.1213	1.9410		2.2621	2.8900
H4	2.1149	1.0348	2.2621		1.7132
H5	2.0231	1.0219	2.8900	1.7132

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.851		C1	N2	H5	119.336
N2	C1	H3	105.302		H4	N2	H5	112.813

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: PBEPBE/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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Number	Element	Mulliken
1	C	-0.222
2	N	-0.579
3	H	0.149
4	H	0.305
5	H	0.348

	x	y	z	Total
	-1.208	-3.261	0.000	3.478
CHELPG
AIM
ESP

	x	y	z
x	3.077	-0.064	0.000
y	-0.064	4.236	0.000
z	0.000	0.000	1.725

<r²>	19.985
(<r²>)^1/2	4.470

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: PBEPBE/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)