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	hartrees
Energy at 0K	-94.521247
Energy at 298.15K	-94.524190
HF Energy	-94.521247
Nuclear repulsion energy	32.374375

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'	3678	3678	15.63	85.27	0.65	0.79
2	A'	3504	3504	6.23	259.43	0.24	0.39
3	A'	2908	2908	151.02	127.43	0.46	0.63
4	A'	1749	1749	23.98	22.98	0.42	0.59
5	A'	1430	1430	40.23	10.91	0.66	0.80
6	A'	1383	1383	33.45	5.89	0.23	0.37
7	A'	1088	1088	28.64	9.51	0.71	0.83
8	A"	1138	1138	23.41	0.40	0.75	0.86
9	A"	937	937	280.41	0.26	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.802
N2	0.062	-0.538
H3	-1.011	1.126
H4	-0.750	-1.156
H5	0.955	-1.016

	C1	N2	H3	H4	H5
C1		1.3395	1.1206	2.1188	2.0249
N2	1.3395		1.9798	1.0200	1.0128
H3	1.1206	1.9798		2.2967	2.9071
H4	2.1188	1.0200	2.2967		1.7104
H5	2.0249	1.0128	2.9071	1.7104

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.276		C1	N2	H5	118.150
N2	C1	H3	106.840		H4	N2	H5	114.574

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: wB97X-D/SDD

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	-0.174
2	N	-0.589
3	H	0.102
4	H	0.310
5	H	0.351

	x	y	z	Total
	-1.565	-3.391	0.000	3.735
CHELPG
AIM
ESP

	x	y	z
x	2.675	-0.152	0.000
y	-0.152	3.917	0.000
z	0.000	0.000	1.551

<r²>	20.183
(<r²>)^1/2	4.492

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: wB97X-D/SDD

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)