Geometry & MOs

Info

ID:	322254
PubChem CID:	126669543
Reduced:	F3N3O4H20C23 (1)
Stoich.:	A3B3C4D20E23 (1)
Weight, g/mol:	459.140591
ΔH_f, kcal/mol:	-256.78
Dipole, Da:	9.97
IP(EA), eV:	-9.31(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[[[2-methoxy-5-(trifluoromethyl)phenyl]carbamoylamino]methyl]phenoxy]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CNC(=O)NC2=CC(=CC(=C2)C(F)(F)F)CO)OC3=CC=C(C=C3)C(=O)N

DOS

IR

Vibrations