Geometry & MOs

Info

ID:	375430
PubChem CID:	131529670
Reduced:	BrOS2C7H7 (1)
Stoich.:	ABC2D7E7 (1)
Weight, g/mol:	249.91217
ΔH_f, kcal/mol:	-12.03
Dipole, Da:	2.75
IP(EA), eV:	-8.86(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-6,7-dihydro-4H-thieno[3,4-c]thiopyran 5-oxide

Drug info:

PubChemData

Smile

C1CSCC2=C1C(=C(S2)Br)O

DOS

IR

Vibrations