Geometry & MOs

Info

ID:	6296
PubChem CID:	67952
Reduced:	ClO2F3N3H15C24 (1)
Stoich.:	AB2C3D3E15F24 (1)
Weight, g/mol:	469.080489
ΔH_f, kcal/mol:	-118.68
Dipole, Da:	2.45
IP(EA), eV:	-8.82(-2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-chloro-5-(trifluoromethyl)phenyl]diazenyl]-3-hydroxy-N-phenylnaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=C(C=CC(=C4)C(F)(F)F)Cl

DOS

IR

Vibrations