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	hartrees
Energy at 0K	-94.395395
Energy at 298.15K	-94.398344
HF Energy	-94.331200
Nuclear repulsion energy	32.436142

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'	3615	3615	13.47	96.88	0.57	0.73
2	A'	3418	3418	17.12	301.03	0.28	0.44
3	A'	2877	2877	159.49	138.55	0.46	0.63
4	A'	1777	1777	10.52	30.79	0.41	0.59
5	A'	1450	1450	36.06	12.57	0.74	0.85
6	A'	1376	1376	13.54	3.53	0.07	0.13
7	A'	1098	1098	27.48	13.33	0.60	0.75
8	A"	1160	1160	13.58	1.10	0.75	0.86
9	A"	934	934	281.70	0.89	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.801
N2	0.062	-0.535
H3	-1.011	1.117
H4	-0.748	-1.156
H5	0.949	-1.022

	C1	N2	H3	H4	H5
C1		1.3356	1.1185	2.1182	2.0275
N2	1.3356		1.9696	1.0214	1.0121
H3	1.1185	1.9696		2.2882	2.9013
H4	2.1182	1.0214	2.2882		1.7028
H5	2.0275	1.0121	2.9013	1.7028

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.466		C1	N2	H5	118.804
N2	C1	H3	106.421		H4	N2	H5	113.730

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B2PLYP/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	-0.025
2	N	-0.694
3	H	0.061
4	H	0.311
5	H	0.346

	x	y	z	Total
	-1.314	-3.248	0.000	3.504
CHELPG
AIM
ESP

	x	y	z
x	2.683	-0.262	-0.000
y	-0.262	3.731	-0.000
z	-0.000	-0.000	1.325

<r²>	20.123
(<r²>)^1/2	4.486

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B2PLYP/6-31G

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)