Geometry & MOs

Info

ID:	227004
PubChem CID:	87559564
Reduced:	NF3O5H26C27 (1)
Stoich.:	AB3C5D26E27 (1)
Weight, g/mol:	259.064471
ΔH_f, kcal/mol:	-314.88
Dipole, Da:	7.31
IP(EA), eV:	-9.36(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-3-(4-formylphenoxy)benzamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C(=O)OCC2=C(C(=CC(=C2C3=CC=CC=C3)OC)C(F)(F)F)CC(=O)O

DOS

IR

Vibrations