Geometry & MOs

Info

ID:	396645
PubChem CID:	135028980
Reduced:	OSH16C20 (1)
Stoich.:	ABC16D20 (1)
Weight, g/mol:	234.071451
ΔH_f, kcal/mol:	66.0
Dipole, Da:	4.2
IP(EA), eV:	-8.5(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-5-cyclohexylidene-4-hydroxy-4H-cyclopenta[b]thiophen-6-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=C(C2=CC=CC=C2)S(=O)C3=CC=CC=C3

DOS

IR

Vibrations