Geometry & MOs

Info

ID:	47279
PubChem CID:	10531082
Reduced:	NO6H27C36 (1)
Stoich.:	AB6C27D36 (1)
Weight, g/mol:	559.981833
ΔH_f, kcal/mol:	-32.92
Dipole, Da:	6.57
IP(EA), eV:	-8.99(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[4-(3-sulfopropoxy)phenyl]tellanylphenoxy]propane-1-sulfonic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC(=C(C=C5)O[C@H](CC6=CC=CC=C6)C(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations