Geometry & MOs

Info

ID:	261203
PubChem CID:	103222444
Reduced:	INCl2H6C10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	406.92437
ΔH_f, kcal/mol:	63.19
Dipole, Da:	3.3
IP(EA), eV:	-9.8(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-5-(3-chloro-4-iodophenyl)thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C/C(=C(\C1=CC(=C(C=C1)I)Cl)/Cl)/C#N

DOS

IR

Vibrations