Geometry & MOs

Info

ID:	177885
PubChem CID:	76249580
Reduced:	NO2C13H17 (2)
Stoich.:	AB2C13D17 (2)
Weight, g/mol:	371.067284
ΔH_f, kcal/mol:	-130.22
Dipole, Da:	7.99
IP(EA), eV:	-8.49(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chloro-3-nitrophenyl)-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)C=CC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C)OC

DOS

IR

Vibrations