Geometry & MOs

Info

ID:	426138
PubChem CID:	135141058
Reduced:	SN2O2C25H36 (1)
Stoich.:	AB2C2D25E36 (1)
Weight, g/mol:	389.88161
ΔH_f, kcal/mol:	-64.9
Dipole, Da:	2.8
IP(EA), eV:	-8.96(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(5-iodo-1,3-thiazol-2-yl)thiophen-2-yl]-5-methyl-1,3-thiazole

Drug info:

PubChemData

Smile

CC(C)(C)CC1=CC(=CO1)CC(C)(CC2=CN=C(O2)CC(C)(C)C)CC3=NC=CS3

DOS

IR

Vibrations