Geometry & MOs

Info

ID:	315411
PubChem CID:	126626057
Reduced:	SC4H6 (2)
Stoich.:	AB4C6 (2)
Weight, g/mol:	370.06411
ΔH_f, kcal/mol:	10.13
Dipole, Da:	1.79
IP(EA), eV:	-8.62(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethoxy-3-iodo-1-oxobutan-2-yl) 2,2,3-trimethylbutanoate

Drug info:

PubChemData

Smile

CCSC(C)C1=CC=CS1

DOS

IR

Vibrations