Geometry & MOs

Info

ID:	30598
PubChem CID:	841556
Reduced:	NSO6C15H15 (1)
Stoich.:	ABC6D15E15 (1)
Weight, g/mol:	336.102941
ΔH_f, kcal/mol:	-215.39
Dipole, Da:	8.08
IP(EA), eV:	-9.05(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-N-cyclopropyl-3-methylquinoline-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC=CO2

DOS

IR

Vibrations