Geometry & MOs

Info

ID:	429342
PubChem CID:	135169316
Reduced:	O2H12C15 (1)
Stoich.:	A2B12C15 (1)
Weight, g/mol:	200.065972
ΔH_f, kcal/mol:	8.46
Dipole, Da:	2.69
IP(EA), eV:	-8.41(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1E,3E)-penta-1,3-dienyl]-1-benzothiophene

Drug info:

PubChemData

Smile

C/C=C/C=C/C1=CC2=C(O1)C=C3C=COC3=C2

DOS

IR

Vibrations