Geometry & MOs

Info

ID:	269645
PubChem CID:	103618440
Reduced:	ClNO3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	401.96768
ΔH_f, kcal/mol:	-101.26
Dipole, Da:	1.47
IP(EA), eV:	-8.95(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-3-[(4-fluoro-2-iodobenzoyl)amino]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)O

DOS

IR

Vibrations