Geometry & MOs

Info

ID:	64638
PubChem CID:	29203709
Reduced:	SN2O4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	469.112999
ΔH_f, kcal/mol:	-95.19
Dipole, Da:	8.16
IP(EA), eV:	-9.23(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1,3-benzothiazol-2-yl)-N-[3-(furan-2-ylmethylsulfamoyl)phenyl]pentanamide

Drug info:

PubChemData

Smile

C1C[C@@H](C=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CO3

DOS

IR

Vibrations