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	hartrees
Energy at 0K	-94.575946
Energy at 298.15K	-94.578854
HF Energy	-94.575946
Nuclear repulsion energy	32.626320

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'	3409	3401	7.38	119.94	0.57	0.73
2	A'	3191	3183	76.05	603.37	0.33	0.49
3	A'	2826	2819	118.90	192.11	0.59	0.75
4	A'	1658	1654	4.40	41.07	0.44	0.61
5	A'	1400	1396	16.58	9.62	0.53	0.69
6	A'	1347	1343	9.89	3.11	0.63	0.77
7	A'	1054	1051	30.08	26.15	0.46	0.63
8	A"	1137	1134	10.67	1.99	0.75	0.86
9	A"	820	818	163.69	1.52	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.793
N2	0.063	-0.525
H3	-1.010	1.099
H4	-0.758	-1.152
H5	0.952	-1.027

	C1	N2	H3	H4	H5
C1		1.3175	1.1154	2.1110	2.0255
N2	1.3175		1.9461	1.0333	1.0216
H3	1.1154	1.9461		2.2651	2.8931
H4	2.1110	1.0333	2.2651		1.7155
H5	2.0255	1.0216	2.8931	1.7155

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.375		C1	N2	H5	119.436
N2	C1	H3	105.940		H4	N2	H5	113.189

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/TZVP

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	-0.204
2	N	-0.305
3	H	0.064
4	H	0.193
5	H	0.253

	x	y	z	Total
	-1.297	-3.244	0.000	3.494
CHELPG
AIM
ESP

	x	y	z
x	3.465	0.020	0.000
y	0.020	4.743	0.000
z	0.000	0.000	2.210

<r²>	20.272
(<r²>)^1/2	4.502

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/TZVP

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)