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	hartrees
Energy at 0K	-94.007005
Energy at 298.15K	-94.009945
HF Energy	-94.007005
Nuclear repulsion energy	32.478506

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3490	3348	9.78
2	A'	3281	3148	33.48
3	A'	2803	2689	146.47
4	A'	1748	1677	6.92
5	A'	1444	1385	32.31
6	A'	1349	1294	10.08
7	A'	1090	1046	30.84
8	A"	1161	1114	12.05
9	A"	911	874	250.57

Atom	x (Å)	y (Å)
C1	0.063	0.797
N2	0.063	-0.529
H3	-1.019	1.104
H4	-0.751	-1.162
H5	0.956	-1.021

	C1	N2	H3	H4	H5
C1		1.3268	1.1241	2.1217	2.0263
N2	1.3268		1.9589	1.0306	1.0202
H3	1.1241	1.9589		2.2819	2.9013
H4	2.1217	1.0306	2.2819		1.7131
H5	2.0263	1.0202	2.9013	1.7131

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.878		C1	N2	H5	118.819
N2	C1	H3	105.822		H4	N2	H5	113.303

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B3PW91/3-21G*

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	-0.080
2	N	-0.710
3	H	0.137
4	H	0.308
5	H	0.345

	x	y	z	Total
	-1.302	-3.302	0.000	3.550
CHELPG
AIM
ESP

	x	y	z
x	2.532	-0.287	0.000
y	-0.287	3.466	0.000
z	0.000	0.000	1.194

<r²>	19.907
(<r²>)^1/2	4.462

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B3PW91/3-21G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)