Geometry & MOs

Info

ID:	228846
PubChem CID:	87565943
Reduced:	PSF2N2O7C30H37 (1)
Stoich.:	ABC2D2E7F30G37 (1)
Weight, g/mol:	638.202716
ΔH_f, kcal/mol:	-408.53
Dipole, Da:	6.15
IP(EA), eV:	-8.85(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOP(=O)(C(C1=CC=C(C=C1)C[C@@H](C(=O)NCCCCOC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)(F)F)OCC

DOS

IR

Vibrations