Geometry & MOs

Info

ID:	78872
PubChem CID:	49742613
Reduced:	BrN2O4H13C16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	348.111007
ΔH_f, kcal/mol:	-89.92
Dipole, Da:	4.2
IP(EA), eV:	-8.9(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(methoxymethyl)-2-oxo-1H-quinolin-7-yl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

COCC1=CC(=O)NC2=C1C=CC(=C2)NC(=O)C3=CC=C(O3)Br

DOS

IR

Vibrations