Geometry & MOs

Info

ID:	10683
PubChem CID:	106616
Reduced:	ClN4O6H23C27 (1)
Stoich.:	AB4C6D23E27 (1)
Weight, g/mol:	534.130612
ΔH_f, kcal/mol:	-116.01
Dipole, Da:	6.58
IP(EA), eV:	-8.16(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-carbamoyl-2-methoxyphenyl)diazenyl]-N-(4-chloro-2,5-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)N)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)NC4=CC(=C(C=C4OC)Cl)OC)O

DOS

IR

Vibrations