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	hartrees
Energy at 0K	-94.558876
Energy at 298.15K	-94.561799
HF Energy	-94.558876
Nuclear repulsion energy	32.887843

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'	3617	3617	11.63	83.38	0.64	0.78
2	A'	3465	3465	10.78	230.19	0.27	0.43
3	A'	2933	2933	131.15	154.98	0.47	0.64
4	A'	1753	1753	16.01	18.73	0.48	0.65
5	A'	1462	1462	16.54	7.95	0.39	0.56
6	A'	1424	1424	20.64	4.36	0.48	0.65
7	A'	1106	1106	22.83	6.65	0.59	0.74
8	A"	1172	1172	12.76	0.98	0.75	0.86
9	A"	819	819	199.86	0.69	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.787
N2	0.063	-0.523
H3	-1.007	1.083
H4	-0.754	-1.130
H5	0.943	-1.019

	C1	N2	H3	H4	H5
C1		1.3100	1.1102	2.0841	2.0093
N2	1.3100		1.9295	1.0178	1.0106
H3	1.1102	1.9295		2.2275	2.8674
H4	2.0841	1.0178	2.2275		1.7007
H5	2.0093	1.0106	2.8674	1.7007

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.646		C1	N2	H5	119.406
N2	C1	H3	105.440		H4	N2	H5	113.948

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: wB97X-D/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	-0.213
2	N	-0.622
3	H	0.147
4	H	0.330
5	H	0.358

	x	y	z	Total
	-1.344	-3.286	0.000	3.550
CHELPG
AIM
ESP

	x	y	z
x	2.858	-0.195	0.000
y	-0.195	3.798	0.000
z	0.000	0.000	1.723

<r²>	19.716
(<r²>)^1/2	4.440

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: wB97X-D/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)