Geometry & MOs

Info

ID:	56692
PubChem CID:	22387980
Reduced:	SO2H20C24 (1)
Stoich.:	AB2C20D24 (1)
Weight, g/mol:	571.9146
ΔH_f, kcal/mol:	-13.44
Dipole, Da:	3.33
IP(EA), eV:	-8.79(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-bromo-2-chlorophenyl)methyl]-N-(5-chlorothiophen-2-yl)sulfonyl-2,7-dimethylimidazo[4,5-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)CC3=CC=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations