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	hartrees
Energy at 0K	-94.455507
Energy at 298.15K	-94.458417
HF Energy	-94.455507
Nuclear repulsion energy	32.799503

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'	3578	3403	9.38	105.82	0.56	0.72
2	A'	3401	3234	24.92	302.91	0.28	0.44
3	A'	2929	2786	135.53	129.40	0.47	0.64
4	A'	1731	1646	7.62	29.39	0.43	0.60
5	A'	1468	1396	12.78	7.17	0.47	0.64
6	A'	1411	1342	20.41	6.40	0.66	0.79
7	A'	1084	1031	26.49	11.91	0.55	0.71
8	A"	1169	1112	10.53	1.21	0.75	0.86
9	A"	802	763	198.49	0.97	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.790
N2	0.062	-0.522
H3	-1.012	1.082
H4	-0.747	-1.149
H5	0.948	-1.017

	C1	N2	H3	H4	H5
C1		1.3120	1.1135	2.1007	2.0126
N2	1.3120		1.9307	1.0234	1.0150
H3	1.1135	1.9307		2.2464	2.8723
H4	2.1007	1.0234	2.2464		1.7004
H5	2.0126	1.0150	2.8723	1.7004

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.753		C1	N2	H5	119.188
N2	C1	H3	105.209		H4	N2	H5	113.059

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HSEh1PBE/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	-0.154
2	N	-0.653
3	H	0.107
4	H	0.333
5	H	0.366

	x	y	z	Total
	-1.187	-3.211	0.000	3.424
CHELPG
AIM
ESP

	x	y	z
x	2.732	-0.234	0.000
y	-0.234	3.701	0.000
z	0.000	0.000	1.421

<r²>	19.649
(<r²>)^1/2	4.433

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HSEh1PBE/6-31G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)