Geometry & MOs

Info

ID:	142206
PubChem CID:	53000618
Reduced:	BrN3O4H18C24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	491.04807
ΔH_f, kcal/mol:	-42.29
Dipole, Da:	6.14
IP(EA), eV:	-9.02(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-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(=CC=C4)Br

DOS

IR

Vibrations