Geometry & MOs

Info

ID:	222392
PubChem CID:	85297345
Reduced:	SF3O4H15C21 (1)
Stoich.:	AB3C4D15E21 (1)
Weight, g/mol:	420.097188
ΔH_f, kcal/mol:	-225.16
Dipole, Da:	6.0
IP(EA), eV:	-9.73(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(benzenesulfonyl)-6-[diethoxyphosphoryl(difluoro)methyl]bicyclo[2.2.1]hept-2-ene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations