Geometry & MOs

Info

ID:	435704
PubChem CID:	135192206
Reduced:	FN2O4C38H39 (1)
Stoich.:	AB2C4D38E39 (1)
Weight, g/mol:	384.150764
ΔH_f, kcal/mol:	-139.53
Dipole, Da:	4.72
IP(EA), eV:	-8.73(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-2-oxo-1-propylquinolin-6-yl)-1-(4-methylphenyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CC(=CC=C2)C3=CN4C=C(C(=C(C4=N3)C5=CC(=C6C(=C5C)CCCO6)F)C(COC(C)(C)C)C(=O)O)C

DOS

IR

Vibrations