Geometry & MOs

Info

ID:	388265
PubChem CID:	134988666
Reduced:	SO2C14H18 (1)
Stoich.:	AB2C14D18 (1)
Weight, g/mol:	272.126858
ΔH_f, kcal/mol:	-70.37
Dipole, Da:	3.04
IP(EA), eV:	-8.86(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-ditert-butyl-3-methyl-2,7lambda4-dithiabicyclo[2.2.1]hept-5-ene 7-oxide

Drug info:

PubChemData

Smile

COC1C=C(CC(S1)CCC2=CC=CC=C2)O

DOS

IR

Vibrations