Geometry & MOs

Info

ID:	269987
PubChem CID:	103621713
Reduced:	ClISN2O3H10C13 (1)
Stoich.:	ABCD2E3F10G13 (1)
Weight, g/mol:	415.96916
ΔH_f, kcal/mol:	-56.01
Dipole, Da:	7.56
IP(EA), eV:	-9.73(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-3-methyl-N-(6-methylsulfonylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=NC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)I

DOS

IR

Vibrations