Geometry & MOs

Info

ID:	269659
PubChem CID:	103618525
Reduced:	ClSN2O3H11C13 (1)
Stoich.:	ABC2D3E11F13 (1)
Weight, g/mol:	435.91454
ΔH_f, kcal/mol:	-68.39
Dipole, Da:	6.57
IP(EA), eV:	-9.64(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-chlorothiophen-2-yl)ethyl]-2-iodo-5-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1C(=O)NCCC2=CC=C(S2)Cl)C(=O)O

DOS

IR

Vibrations