Geometry & MOs

Info

ID:	288942
PubChem CID:	104328740
Reduced:	FN2O2H13C16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	286.148141
ΔH_f, kcal/mol:	-64.59
Dipole, Da:	5.07
IP(EA), eV:	-9.25(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(ethylaminomethyl)phenyl]-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C2=NC3=C(C=CC=C3N2)C(=O)OC

DOS

IR

Vibrations