Geometry & MOs

Info

ID:	14046
PubChem CID:	402266
Reduced:	I2N2O4H12C15 (1)
Stoich.:	A2B2C4D12E15 (1)
Weight, g/mol:	537.88865
ΔH_f, kcal/mol:	-48.4
Dipole, Da:	1.62
IP(EA), eV:	-8.76(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-N-[(4-hydroxy-3-methoxyphenyl)methylideneamino]-3,5-diiodobenzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C=NNC(=O)C2=C(C(=CC(=C2)I)I)O)O

DOS

IR

Vibrations