Geometry & MOs

Info

ID:	394016
PubChem CID:	135022172
Reduced:	PF2O4H23C24 (1)
Stoich.:	AB2C4D23E24 (1)
Weight, g/mol:	284.087101
ΔH_f, kcal/mol:	-234.0
Dipole, Da:	8.68
IP(EA), eV:	-8.43(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,4S,9bS)-4-phenylsulfanyl-3,3a,4,9b-tetrahydro-2H-furo[3,2-c]chromene

Drug info:

PubChemData

Smile

C1C[C@H](C([C@H](C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3)O)OC4=CC(=C(C=C4O)F)F

DOS

IR

Vibrations