Geometry & MOs

Info

ID:	229693
PubChem CID:	87568496
Reduced:	PSF2N2O6C30H37 (1)
Stoich.:	ABC2D2E6F30G37 (1)
Weight, g/mol:	622.207801
ΔH_f, kcal/mol:	-373.78
Dipole, Da:	4.77
IP(EA), eV:	-9.14(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzenesulfonamido)-3-[4-[diethoxyphosphoryl(difluoro)methyl]phenyl]-N-(4-phenylbutyl)propanamide

Drug info:

PubChemData

Smile

CCOP(=O)(C(C1=CC=C(C=C1)C[C@@H](C(=O)NCCCCC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)(F)F)OCC

DOS

IR

Vibrations