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	hartrees
Energy at 0K	-94.595898
Energy at 298.15K	-94.598814
HF Energy	-94.595898
Nuclear repulsion energy	32.829552

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'	3549	3430	8.35	94.29	0.60	0.75
2	A'	3363	3250	37.01	349.20	0.31	0.47
3	A'	2903	2805	136.68	168.33	0.51	0.68
4	A'	1740	1681	8.95	26.78	0.44	0.61
5	A'	1444	1395	18.77	8.00	0.58	0.73
6	A'	1405	1358	11.92	1.66	0.38	0.55
7	A'	1092	1055	27.29	12.15	0.52	0.68
8	A"	1167	1128	12.82	0.97	0.75	0.86
9	A"	810	783	189.88	1.19	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.788
N2	0.063	-0.523
H3	-1.006	1.090
H4	-0.754	-1.139
H5	0.944	-1.022

	C1	N2	H3	H4	H5
C1		1.3111	1.1104	2.0927	2.0135
N2	1.3111		1.9344	1.0226	1.0131
H3	1.1104	1.9344		2.2424	2.8745
H4	2.0927	1.0226	2.2424		1.7020
H5	2.0135	1.0131	2.8745	1.7020

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.024		C1	N2	H5	119.518
N2	C1	H3	105.743		H4	N2	H5	113.458

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B3LYP/6-311G*

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	-0.206
2	N	-0.599
3	H	0.144
4	H	0.314
5	H	0.348

	x	y	z	Total
	-1.283	-3.226	0.000	3.472
CHELPG
AIM
ESP

	x	y	z
x	2.925	-0.140	0.000
y	-0.140	3.957	0.000
z	0.000	0.000	1.710

<r²>	19.831
(<r²>)^1/2	4.453

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B3LYP/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)