Geometry & MOs

Info

ID:	158159
PubChem CID:	56463079
Reduced:	SO3N5C26H27 (1)
Stoich.:	AB3C5D26E27 (1)
Weight, g/mol:	487.18894
ΔH_f, kcal/mol:	-3.7
Dipole, Da:	4.24
IP(EA), eV:	-9.05(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-6-(diethylsulfamoyl)-2-oxo-1H-quinoline-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC(C4=NC(=NO4)C5CC5)C(C)C)NC2=S)C

DOS

IR

Vibrations