Geometry & MOs

Info

ID:	80225
PubChem CID:	49833647
Reduced:	SN4O4H20C23 (1)
Stoich.:	AB4C4D20E23 (1)
Weight, g/mol:	559.005485
ΔH_f, kcal/mol:	-25.16
Dipole, Da:	4.92
IP(EA), eV:	-8.44(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2-chlorophenyl)-5-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,2,4-triazol-3-yl]pyridine-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=C(C=CO5)C

DOS

IR

Vibrations