Geometry & MOs

Info

ID:	391137
PubChem CID:	135003055
Reduced:	SCl5C9H11 (1)
Stoich.:	AB5C9D11 (1)
Weight, g/mol:	508.113954
ΔH_f, kcal/mol:	-21.3
Dipole, Da:	2.69
IP(EA), eV:	-9.2(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3Z)-1,2,3,4-tetrachloro-4-nonylsulfanylbuta-1,3-dienyl]sulfanylnonane

Drug info:

PubChemData

Smile

CCCCCS/C(=C(\C(=C(Cl)Cl)Cl)/Cl)/Cl

DOS

IR

Vibrations