Geometry & MOs

Info

ID:	411513
PubChem CID:	135084344
Reduced:	OCl2C10H10 (1)
Stoich.:	AB2C10D10 (1)
Weight, g/mol:	202.09938
ΔH_f, kcal/mol:	-22.95
Dipole, Da:	3.28
IP(EA), eV:	-8.96(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-3-phenoxy-8-oxabicyclo[3.2.1]oct-6-ene

Drug info:

PubChemData

Smile

C=CCCOC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations