Geometry & MOs

Info

ID:	202587
PubChem CID:	79692897
Reduced:	IN2O2S2H9C12 (1)
Stoich.:	AB2C2D2E9F12 (1)
Weight, g/mol:	448.89459
ΔH_f, kcal/mol:	14.44
Dipole, Da:	6.71
IP(EA), eV:	-9.24(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-bromophenyl)propyl]-5-iodothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)C3=CSC(=C3)I

DOS

IR

Vibrations