Geometry & MOs

Info

ID:	22003
PubChem CID:	594740
Reduced:	S2C7H12 (1)
Stoich.:	A2B7C12 (1)
Weight, g/mol:	160.038043
ΔH_f, kcal/mol:	19.77
Dipole, Da:	1.38
IP(EA), eV:	-8.17(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylsulfanyl-2-methylsulfanylbuta-1,3-diene

Drug info:

PubChemData

Smile

CCSC=C(C=C)SC

DOS

IR

Vibrations