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	hartrees
Energy at 0K	-17.244142
Energy at 298.15K	-17.247078
HF Energy	-17.244142
Nuclear repulsion energy	18.965315

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'	3690	3690	16.39	80.79	0.69	0.82
2	A'	3514	3514	5.10	267.95	0.23	0.38
3	A'	2917	2917	181.85	139.69	0.49	0.66
4	A'	1732	1732	28.66	24.05	0.35	0.52
5	A'	1424	1424	55.94	16.10	0.75	0.86
6	A'	1372	1372	34.60	5.62	0.18	0.31
7	A'	1080	1080	29.99	13.02	0.72	0.84
8	A"	1132	1132	25.30	0.19	0.75	0.86
9	A"	920	920	302.36	0.07	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.811
N2	0.063	-0.543
H3	-1.021	1.119
H4	-0.755	-1.160
H5	0.960	-1.020

	C1	N2	H3	H4	H5
C1		1.3540	1.1266	2.1336	2.0392
N2	1.3540		1.9842	1.0240	1.0165
H3	1.1266	1.9842		2.2945	2.9157
H4	2.1336	1.0240	2.2945		1.7207
H5	2.0392	1.0165	2.9157	1.7207

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.043		C1	N2	H5	117.984
N2	C1	H3	105.874		H4	N2	H5	114.973

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: wB97X-D/CEP-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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Number	Element	Mulliken
1	C	-0.301
2	N	-0.402
3	H	0.080
4	H	0.292
5	H	0.330

	x	y	z	Total
	-1.622	-3.414	0.000	3.780
CHELPG
AIM
ESP

	x	y	z
x	2.610	-0.154	0.000
y	-0.154	3.900	0.000
z	0.000	0.000	1.768

<r²>	18.443
(<r²>)^1/2	4.295

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: wB97X-D/CEP-31G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)