Geometry & MOs

Info

ID:	12777
PubChem CID:	145498
Reduced:	SC6H12 (1)
Stoich.:	AB6C12 (1)
Weight, g/mol:	116.065972
ΔH_f, kcal/mol:	-7.0
Dipole, Da:	2.08
IP(EA), eV:	-8.49(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylsulfanylbut-2-ene

Drug info:

PubChemData

Smile

CCSCC=CC

DOS

IR

Vibrations