Geometry & MOs

Info

ID:	339505
PubChem CID:	127261438
Reduced:	OSeC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	314.097666
ΔH_f, kcal/mol:	-33.77
Dipole, Da:	3.36
IP(EA), eV:	-8.25(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-benzylidene-4-(4-methylphenyl)sulfonyloxolane

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@@H](O1)C[Se]C2=CC=CC=C2

DOS

IR

Vibrations