Geometry & MOs

Info

ID:	78957
PubChem CID:	49742851
Reduced:	N2O2H26C27 (1)
Stoich.:	A2B2C26D27 (1)
Weight, g/mol:	413.140927
ΔH_f, kcal/mol:	-31.54
Dipole, Da:	4.55
IP(EA), eV:	-8.8(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylsulfamoyl)-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations