Geometry & MOs

Info

ID:	323403
PubChem CID:	126674709
Reduced:	F3N3O3H16C23 (1)
Stoich.:	A3B3C3D16E23 (1)
Weight, g/mol:	470.078387
ΔH_f, kcal/mol:	-162.85
Dipole, Da:	6.37
IP(EA), eV:	-9.13(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxybenzoyl)oxy-5-[(4-methyl-3-sulfophenyl)diazenyl]benzoic acid

Drug info:

PubChemData

Smile

C1COC2=C(N1C(=O)NC3=CC=CC(=C3)C(F)(F)F)C=C(C=C2)OC4=CC=C(C=C4)C#N

DOS

IR

Vibrations