Geometry & MOs

Info

ID:	169376
PubChem CID:	75096761
Reduced:	ClF3N4O4H18C20 (1)
Stoich.:	AB3C4D4E18F20 (1)
Weight, g/mol:	466.146404
ΔH_f, kcal/mol:	-269.05
Dipole, Da:	6.43
IP(EA), eV:	-9.43(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-methoxy-3-[(2-oxo-1,3,3a,4,5,6,7,7a-octahydroimidazo[4,5-b]pyridin-7-yl)oxy]phenyl]-3-(trifluoromethoxy)benzamide

Drug info:

PubChemData

Smile

C1CNC2C(C1OC3=CC(=CC(=C3)NC(=O)C4=CC(=CC=C4)OC(F)(F)F)Cl)NC(=O)N2

DOS

IR

Vibrations