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	hartrees
Energy at 0K	-94.500635
Energy at 298.15K	-94.503555
HF Energy	-94.500635
Nuclear repulsion energy	32.183538

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'	3430	3404	3.33	124.67	0.48	0.65
2	A'	3132	3108	132.66	536.22	0.33	0.50
3	A'	2736	2715	172.01	155.23	0.59	0.74
4	A'	1704	1691	2.13	50.68	0.39	0.56
5	A'	1407	1397	28.96	10.68	0.70	0.83
6	A'	1304	1294	7.82	1.84	0.75	0.86
7	A'	1053	1045	41.14	31.83	0.51	0.67
8	A"	1122	1114	12.66	1.52	0.75	0.86
9	A"	888	881	236.26	2.67	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.806
N2	0.063	-0.534
H3	-1.027	1.115
H4	-0.748	-1.186
H5	0.961	-1.026

	C1	N2	H3	H4	H5
C1		1.3406	1.1323	2.1510	2.0409
N2	1.3406		1.9770	1.0403	1.0241
H3	1.1323	1.9770		2.3182	2.9219
H4	2.1510	1.0403	2.3182		1.7165
H5	2.0409	1.0241	2.9219	1.7165

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	128.785		C1	N2	H5	118.714
N2	C1	H3	105.847		H4	N2	H5	112.501

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/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	-0.043
2	N	-0.606
3	H	0.057
4	H	0.271
5	H	0.320

	x	y	z	Total
	-1.138	-3.154	0.000	3.353
CHELPG
AIM
ESP

	x	y	z
x	2.898	-0.126	0.000
y	-0.126	4.125	0.000
z	0.000	0.000	1.323

<r²>	20.269
(<r²>)^1/2	4.502

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)