Geometry & MOs

Info

ID:	202550
PubChem CID:	79685945
Reduced:	IOSH11C13 (1)
Stoich.:	ABCD11E13 (1)
Weight, g/mol:	421.85854
ΔH_f, kcal/mol:	22.05
Dipole, Da:	3.53
IP(EA), eV:	-9.29(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-4-bromophenyl)-5-iodothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(=O)C2=CSC(=C2)I

DOS

IR

Vibrations