Geometry & MOs

Info

ID:	395257
PubChem CID:	135025032
Reduced:	NC23H33 (1)
Stoich.:	AB23C33 (1)
Weight, g/mol:	566.9768
ΔH_f, kcal/mol:	8.87
Dipole, Da:	0.92
IP(EA), eV:	-8.41(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-3-(benzenesulfonyl)-1-phenylmethoxyprop-1-en-2-yl]-N-(4-chloro-2-iodophenyl)formamide

Drug info:

PubChemData

Smile

CC(C)N(CCCCC1=CC=CC=C1)C(C)CCC2=CC=CC=C2

DOS

IR

Vibrations