Geometry & MOs

Info

ID:	142207
PubChem CID:	53000619
Reduced:	BrN3O4H18C24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	477.109149
ΔH_f, kcal/mol:	-42.2
Dipole, Da:	9.74
IP(EA), eV:	-9.17(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methoxyphenyl)-2-[6-methoxy-4-oxo-3-(pyridine-4-carbonyl)quinolin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N(C=C(C2=O)C(=O)C3=CC=NC=C3)CC(=O)NC4=CC=C(C=C4)Br

DOS

IR

Vibrations