Geometry & MOs

Info

ID:	142355
PubChem CID:	53021012
Reduced:	SO2N3C23H25 (1)
Stoich.:	AB2C3D23E25 (1)
Weight, g/mol:	458.108248
ΔH_f, kcal/mol:	-15.94
Dipole, Da:	6.06
IP(EA), eV:	-8.35(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[8-methoxy-2-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NC2=CC(=NC3=C2C=CC=C3OC)C(=O)N4CCSCC4

DOS

IR

Vibrations