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	hartrees
Energy at 0K	-94.539166
Energy at 298.15K	-94.542077
HF Energy	-94.539166
Nuclear repulsion energy	32.790049

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'	3621	3621	13.56	98.91	0.63	0.77
2	A'	3468	3468	7.43	237.32	0.24	0.39
3	A'	2917	2917	138.39	127.17	0.43	0.60
4	A'	1712	1712	14.24	22.43	0.46	0.63
5	A'	1457	1457	15.79	8.62	0.38	0.55
6	A'	1408	1408	21.73	7.87	0.62	0.77
7	A'	1086	1086	21.53	7.91	0.58	0.73
8	A"	1162	1162	10.45	1.29	0.75	0.86
9	A"	801	801	195.36	0.77	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.791
N2	0.063	-0.524
H3	-1.013	1.080
H4	-0.749	-1.141
H5	0.948	-1.016

	C1	N2	H3	H4	H5
C1		1.3148	1.1136	2.0950	2.0120
N2	1.3148		1.9314	1.0193	1.0129
H3	1.1136	1.9314		2.2366	2.8704
H4	2.0950	1.0193	2.2366		1.7017
H5	2.0120	1.0129	2.8704	1.7017

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.220		C1	N2	H5	119.056
N2	C1	H3	105.078		H4	N2	H5	113.725

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: wB97X-D/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	-0.112
2	N	-0.535
3	H	0.064
4	H	0.278
5	H	0.306

	x	y	z	Total
	-1.203	-3.216	0.000	3.434
CHELPG
AIM
ESP

	x	y	z
x	2.744	-0.284	0.000
y	-0.284	3.628	0.000
z	0.000	0.000	1.461

<r²>	19.620
(<r²>)^1/2	4.429

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: wB97X-D/6-31G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)