Geometry & MOs

Info

ID:	269652
PubChem CID:	103618479
Reduced:	BrN2O2H11C16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	388.00726
ΔH_f, kcal/mol:	-6.12
Dipole, Da:	4.68
IP(EA), eV:	-9.06(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-3-methyl-N-quinolin-6-ylbenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations