Geometry & MOs

Info

ID:	262482
PubChem CID:	103295836
Reduced:	FON3C16H18 (1)
Stoich.:	ABC3D16E18 (1)
Weight, g/mol:	253.122655
ΔH_f, kcal/mol:	-47.9
Dipole, Da:	2.85
IP(EA), eV:	-8.75(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamidoethyl)-5-amino-2-fluoro-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1F)C(=O)N(C)CCC2=CC=CC=N2)N

DOS

IR

Vibrations