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	hartrees
Energy at 0K	-94.537258
Energy at 298.15K	-94.540132
HF Energy	-94.537258
Nuclear repulsion energy	32.406699

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'	3381	3386	5.93	120.13	0.53	0.70
2	A'	3130	3135	96.26	532.98	0.31	0.48
3	A'	2778	2782	144.42	186.88	0.54	0.70
4	A'	1601	1604	1.24	40.31	0.43	0.61
5	A'	1390	1392	9.25	9.06	0.56	0.72
6	A'	1325	1327	9.65	2.03	0.75	0.85
7	A'	1025	1026	30.57	21.70	0.44	0.62
8	A"	1124	1126	10.60	1.34	0.75	0.86
9	A"	751	752	124.32	2.17	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.798
N2	0.063	-0.526
H3	-1.028	1.098
H4	-0.757	-1.169
H5	0.960	-1.031

	C1	N2	H3	H4	H5
C1		1.3241	1.1318	2.1313	2.0367
N2	1.3241		1.9570	1.0422	1.0291
H3	1.1318	1.9570		2.2838	2.9130
H4	2.1313	1.0422	2.2838		1.7227
H5	2.0367	1.0291	2.9130	1.7227

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	128.096		C1	N2	H5	119.360
N2	C1	H3	105.399		H4	N2	H5	112.544

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/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	-0.207
2	N	0.034
3	H	0.002
4	H	0.065
5	H	0.106

	x	y	z	Total
	-1.086	-3.190	0.000	3.369
CHELPG
AIM
ESP

	x	y	z
x	3.053	-0.142	0.000
y	-0.142	4.140	0.000
z	0.000	0.000	1.598

<r²>	20.082
(<r²>)^1/2	4.481

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/cc-pVDZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)