Geometry & MOs

Info

ID:	56708
PubChem CID:	22388560
Reduced:	NSCl2O4H21C25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	498.112854
ΔH_f, kcal/mol:	-105.24
Dipole, Da:	6.55
IP(EA), eV:	-9.28(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(benzenesulfonyl)-3-[(2-chloro-4-propan-2-yloxyphenyl)methyl]-2-methylimidazo[4,5-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CCCC1=C(C2=C(O1)C=CC(=C2)C(=O)NS(=O)(=O)C3=CC=CC=C3)CC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations