Geometry & MOs

Info

ID:	229160
PubChem CID:	87567081
Reduced:	PF3O3C8H8 (1)
Stoich.:	AB3C3D8E8 (1)
Weight, g/mol:	602.085493
ΔH_f, kcal/mol:	-311.5
Dipole, Da:	4.48
IP(EA), eV:	-9.61(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2S)-2-(benzenesulfonamido)-3-[3-(4-chlorophenoxy)propylamino]-3-oxopropyl]phenoxy]-(difluoromethyl)phosphinic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OP(=O)(C(F)F)O)F

DOS

IR

Vibrations