Geometry & MOs

Info

ID:	28311
PubChem CID:	826975
Reduced:	ClO2N5H14C16 (1)
Stoich.:	AB2C5D14E16 (1)
Weight, g/mol:	229.090292
ΔH_f, kcal/mol:	2.58
Dipole, Da:	2.34
IP(EA), eV:	-8.63(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-4-fluorobenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C3=C(C=CC(=C3)Cl)O

DOS

IR

Vibrations