Geometry & MOs

Info

ID:	189251
PubChem CID:	77833810
Reduced:	NSO4C17H19 (1)
Stoich.:	ABC4D17E19 (1)
Weight, g/mol:	392.069448
ΔH_f, kcal/mol:	-119.42
Dipole, Da:	6.06
IP(EA), eV:	-9.12(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-acetamido-5,7-dichloro-4-phenyl-3,4-dihydro-2H-quinoline-2-carboxylate

Drug info:

PubChemData

Smile

CC1C2C(C(=O)N2C(=C1SCC3=CC=CC=C3)C(=O)O)C(C)O

DOS

IR

Vibrations