Geometry & MOs

Info

ID:	142205
PubChem CID:	53000503
Reduced:	O3N4C17H18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	491.04807
ΔH_f, kcal/mol:	-19.85
Dipole, Da:	7.97
IP(EA), eV:	-9.48(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-2-[6-methoxy-4-oxo-3-(pyridine-4-carbonyl)quinolin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=NC(=C2C(=NOC2=N1)C)NCC3=CC=CC(=C3)C

DOS

IR

Vibrations