iron(3+); 3-methylbutanoic acid; triperchlorate

Systemtic Name: iron(3+); 3-methylbutanoic acid; triperchlorate Openeye Name: ferric 3-methylbutanoic acid triperchlorate CAS Name: iron(3+); 3-methylbutanoic acid; triperchlorate IUPAC Name: iron(3+); 3-methylbutanoic acid; triperchlorate Traditional Name: ferric 3-methylbutyric acid triperchlorate Formula: C30H60Cl3FeO24 MolecularWeight: 966.987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+3]

Isomeric SMILES

CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.CC(C)CC(=O)O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+3]

InChI

InChI=1S/6C5H10O2.3ClHO4.Fe/c6*1-4(2)3-5(6)7;3*2-1(3,4)5;/h6*4H,3H2,1-2H3,(H,6,7);3*(H,2,3,4,5);/q;;;;;;;;;+3/p-3