Geometry & MOs

Info

ID:	275524
PubChem CID:	103816508
Reduced:	BrClFN2O2H9C13 (1)
Stoich.:	ABCD2E2F9G13 (1)
Weight, g/mol:	313.94577
ΔH_f, kcal/mol:	-67.5
Dipole, Da:	8.49
IP(EA), eV:	-9.18(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)-3-methylfuran-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)NC2=CC(=C(N=C2)Cl)Br)F

DOS

IR

Vibrations