Geometry & MOs

Info

ID:	288943
PubChem CID:	104328776
Reduced:	FON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	272.132491
ΔH_f, kcal/mol:	-58.53
Dipole, Da:	4.82
IP(EA), eV:	-8.69(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(aminomethyl)phenyl]methyl]-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CCNCC1=CC=CC=C1NC(=O)C2=C(C=C(C=C2)F)C

DOS

IR

Vibrations