Geometry & MOs

Info

ID:	47011
PubChem CID:	10528922
Reduced:	OPBr2H15C22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	486.04741
ΔH_f, kcal/mol:	59.81
Dipole, Da:	5.47
IP(EA), eV:	-9.61(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-iodo-N-[4-[1-(propan-2-ylsulfonylamino)propan-2-yl]phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(P(=O)(C(=C2C3=CC=CC=C3)Br)C4=CC=CC=C4)Br

DOS

IR

Vibrations