Geometry & MOs

Info

ID:	288860
PubChem CID:	104327189
Reduced:	FON2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	272.132491
ΔH_f, kcal/mol:	-51.37
Dipole, Da:	1.12
IP(EA), eV:	-8.84(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(aminomethyl)-2-methylphenyl]-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)NC2=CC=C(C=C2)CN

DOS

IR

Vibrations