Geometry & MOs

Info

ID:	3142
PubChem CID:	9217
Reduced:	OSH8C12 (1)
Stoich.:	ABC8D12 (1)
Weight, g/mol:	200.029586
ΔH_f, kcal/mol:	18.81
Dipole, Da:	0.28
IP(EA), eV:	-8.11(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenoxathiine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)OC3=CC=CC=C3S2

DOS

IR

Vibrations