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	hartrees
Energy at 0K	-94.023050
Energy at 298.15K	-94.025990
HF Energy	-94.023050
Nuclear repulsion energy	33.234574

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'	3845	3485	35.46	64.77	0.71	0.83
2	A'	3725	3376	3.68	145.49	0.16	0.27
3	A'	3094	2804	110.06	148.34	0.42	0.59
4	A'	1833	1661	42.51	8.03	0.60	0.75
5	A'	1509	1368	16.58	2.34	0.10	0.19
6	A'	1500	1359	42.82	8.02	0.36	0.53
7	A'	1153	1045	20.53	2.82	0.52	0.69
8	A"	1213	1099	11.67	1.58	0.75	0.86
9	A"	821	744	193.01	0.08	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.778
N2	0.062	-0.523
H3	-0.983	1.101
H4	-0.754	-1.096
H5	0.926	-1.015

	C1	N2	H3	H4	H5
C1		1.3008	1.0941	2.0441	1.9902
N2	1.3008		1.9312	0.9975	0.9941
H3	1.0941	1.9312		2.2090	2.8498
H4	2.0441	0.9975	2.2090		1.6820
H5	1.9902	0.9941	2.8498	1.6820

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	125.078		C1	N2	H5	119.678
N2	C1	H3	107.173		H4	N2	H5	115.244

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HF/Def2TZVPP

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	-0.109
2	N	-0.325
3	H	0.025
4	H	0.186
5	H	0.223

	x	y	z	Total
	-1.468	-3.081	0.000	3.413
CHELPG
AIM
ESP

	x	y	z
x	3.078	-0.147	0.000
y	-0.147	3.839	0.000
z	0.000	0.000	2.295

<r²>	19.669
(<r²>)^1/2	4.435

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)