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	hartrees
Energy at 0K	-94.468999
Energy at 298.15K	-94.471911
HF Energy	-94.371886
Nuclear repulsion energy	32.764866

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'	3616	3616	12.99	97.10	0.60	0.75
2	A'	3446	3446	11.06	253.86	0.25	0.40
3	A'	2950	2950	133.86	123.94	0.44	0.61
4	A'	1721	1721	9.44	23.77	0.44	0.61
5	A'	1447	1447	17.67	10.89	0.51	0.67
6	A'	1414	1414	13.95	5.24	0.40	0.58
7	A'	1082	1082	22.52	9.56	0.55	0.71
8	A"	1174	1174	10.13	1.14	0.75	0.86
9	A"	801	801	188.72	0.81	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.793
N2	0.062	-0.525
H3	-1.009	1.080
H4	-0.748	-1.143
H5	0.947	-1.017

	C1	N2	H3	H4	H5
C1		1.3175	1.1097	2.0986	2.0141
N2	1.3175		1.9299	1.0195	1.0121
H3	1.1097	1.9299		2.2384	2.8678
H4	2.0986	1.0195	2.2384		1.6999
H5	2.0141	1.0121	2.8678	1.6999

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.324		C1	N2	H5	119.086
N2	C1	H3	105.014		H4	N2	H5	113.590

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B2PLYP/6-31G**

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	-0.098
2	N	-0.507
3	H	0.051
4	H	0.262
5	H	0.292

	x	y	z	Total
	-1.164	-3.198	0.000	3.403
CHELPG
AIM
ESP

	x	y	z
x	2.729	-0.255	0.000
y	-0.255	3.674	-0.000
z	0.000	-0.000	1.439

<r²>	19.709
(<r²>)^1/2	4.440

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B2PLYP/6-31G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)