Geometry & MOs

Info

ID:	262015
PubChem CID:	103266365
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	353.00628
ΔH_f, kcal/mol:	-147.72
Dipole, Da:	5.8
IP(EA), eV:	-9.57(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(3-bromo-4-fluoroanilino)ethoxy]benzoic acid

Drug info:

PubChemData

Smile

COC1(CCOC1)CNCC2=CC(=CC=C2)C(=O)O

DOS

IR

Vibrations