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	hartrees
Energy at 0K	-94.543348
Energy at 298.15K	-94.546270
HF Energy	-94.543348
Nuclear repulsion energy	32.809778

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'	3604	3604	31.40	79.75	0.69	0.81
2	A'	3455	3455	0.73	255.40	0.20	0.33
3	A'	2965	2965	99.90	174.40	0.45	0.62
4	A'	1687	1687	29.34	10.54	0.69	0.81
5	A'	1455	1455	17.10	12.35	0.20	0.33
6	A'	1386	1386	16.52	6.03	0.10	0.17
7	A'	1071	1071	19.96	6.35	0.27	0.43
8	A"	1151	1151	12.72	0.41	0.75	0.86
9	A"	830	830	152.07	0.23	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.788
N2	0.063	-0.525
H3	-1.008	1.092
H4	-0.762	-1.124
H5	0.947	-1.021

	C1	N2	H3	H4	H5
C1		1.3125	1.1138	2.0826	2.0138
N2	1.3125		1.9392	1.0199	1.0142
H3	1.1138	1.9392		2.2297	2.8792
H4	2.0826	1.0199	2.2297		1.7122
H5	2.0138	1.0142	2.8792	1.7122

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.023		C1	N2	H5	119.329
N2	C1	H3	105.821		H4	N2	H5	114.649

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: M06-2X/aug-cc-pVDZ

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	0.050
2	N	0.251
3	H	-0.232
4	H	-0.071
5	H	0.002

	x	y	z	Total
	-1.328	-3.227	0.000	3.489
CHELPG
AIM
ESP

	x	y	z
x	3.683	0.009	0.000
y	0.009	4.620	0.000
z	0.000	0.000	2.836

<r²>	20.065
(<r²>)^1/2	4.479

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: M06-2X/aug-cc-pVDZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)