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	hartrees
Energy at 0K	-94.542831
Energy at 298.15K	-94.545757
HF Energy	-94.542831
Nuclear repulsion energy	32.954970

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'	3596	3447	10.02	92.46	0.62	0.77
2	A'	3424	3283	22.89	296.50	0.29	0.45
3	A'	2929	2808	134.32	161.26	0.49	0.66
4	A'	1750	1677	11.32	23.16	0.46	0.63
5	A'	1466	1406	13.24	7.28	0.44	0.61
6	A'	1417	1358	19.56	3.28	0.58	0.73
7	A'	1095	1050	25.23	9.72	0.54	0.70
8	A"	1175	1127	12.64	1.02	0.75	0.86
9	A"	829	795	191.88	0.97	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.786
N2	0.063	-0.520
H3	-1.007	1.080
H4	-0.750	-1.133
H5	0.942	-1.017

	C1	N2	H3	H4	H5
C1		1.3059	1.1090	2.0838	2.0057
N2	1.3059		1.9244	1.0181	1.0099
H3	1.1090	1.9244		2.2274	2.8624
H4	2.0838	1.0181	2.2274		1.6963
H5	2.0057	1.0099	2.8624	1.6963

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.999		C1	N2	H5	119.470
N2	C1	H3	105.377		H4	N2	H5	113.531

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B1B95/6-311G*

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	-0.211
2	N	-0.618
3	H	0.149
4	H	0.324
5	H	0.356

	x	y	z	Total
	-1.282	-3.263	0.000	3.506
CHELPG
AIM
ESP

	x	y	z
x	2.891	-0.160	0.000
y	-0.160	3.863	0.000
z	0.000	0.000	1.699

<r²>	19.666
(<r²>)^1/2	4.435

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B1B95/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)