Geometry & MOs

Info

ID:	408463
PubChem CID:	135081229
Reduced:	ISC11H11 (1)
Stoich.:	ABC11D11 (1)
Weight, g/mol:	233.105193
ΔH_f, kcal/mol:	67.8
Dipole, Da:	2.18
IP(EA), eV:	-8.45(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C=CC/C=C(\SC1=CC=CC=C1)/I

DOS

IR

Vibrations