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	hartrees
Energy at 0K	-94.577370
Energy at 298.15K	-94.580263
HF Energy	-94.577370
Nuclear repulsion energy	32.672431

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'	3418	3399	14.33	78.70	0.67	0.80
2	A'	3214	3196	62.33	541.18	0.29	0.45
3	A'	2831	2815	98.81	172.04	0.63	0.78
4	A'	1640	1631	6.84	29.66	0.58	0.73
5	A'	1393	1386	13.64	13.35	0.16	0.28
6	A'	1337	1329	11.19	13.94	0.33	0.49
7	A'	1043	1038	28.06	18.22	0.37	0.54
8	A"	1127	1121	10.24	0.32	0.75	0.86
9	A"	786	782	136.30	0.66	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.790
N2	0.063	-0.525
H3	-1.004	1.107
H4	-0.762	-1.145
H5	0.950	-1.029

	C1	N2	H3	H4	H5
C1		1.3155	1.1128	2.1035	2.0246
N2	1.3155		1.9498	1.0313	1.0205
H3	1.1128	1.9498		2.2648	2.8952
H4	2.1035	1.0313	2.2648		1.7152
H5	2.0246	1.0205	2.8952	1.7152

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.941		C1	N2	H5	119.622
N2	C1	H3	106.524		H4	N2	H5	113.437

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/6-311+G(3df,2p)

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	-0.144
2	N	-0.386
3	H	0.138
4	H	0.174
5	H	0.218

	x	y	z	Total
	-1.314	-3.228	0.000	3.485
CHELPG
AIM
ESP

	x	y	z
x	3.834	0.216	0.000
y	0.216	5.192	0.000
z	0.000	0.000	2.981

<r²>	20.353
(<r²>)^1/2	4.511

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)