Geometry & MOs

Info

ID:	387767
PubChem CID:	134986812
Reduced:	C13H16 (1)
Stoich.:	A13B16 (1)
Weight, g/mol:	264.100643
ΔH_f, kcal/mol:	36.53
Dipole, Da:	0.6
IP(EA), eV:	-9.13(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1E,3E)-5,5-bis(ethylsulfanyl)penta-1,3-dienyl]benzene

Drug info:

PubChemData

Smile

CCCC=C=C(C)C1=CC=CC=C1

DOS

IR

Vibrations