Geometry & MOs

Info

ID:	269447
PubChem CID:	103617506
Reduced:	ClION4C14H14 (1)
Stoich.:	ABCD4E14F14 (1)
Weight, g/mol:	441.96149
ΔH_f, kcal/mol:	45.14
Dipole, Da:	6.08
IP(EA), eV:	-9.75(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5-chloro-2-iodobenzoyl)piperidin-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CN(CC1=NN=C2N1CCC2)C(=O)C3=C(C=CC(=C3)Cl)I

DOS

IR

Vibrations