Geometry & MOs

Info

ID:	383197
PubChem CID:	134974778
Reduced:	ClNO2H16C21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	464.97927
ΔH_f, kcal/mol:	-21.49
Dipole, Da:	2.79
IP(EA), eV:	-8.8(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(4-chloro-2-iodophenyl)-4-fluorobenzamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)N(C3=C2C=C(C=C3)Cl)CC4=CC=CC=C4

DOS

IR

Vibrations