bis(oxidanidyl)-bis(oxidanylidene)molybdenum; tri(tridecyl)azanium

Systemtic Name: bis(oxidanidyl)-bis(oxidanylidene)molybdenum; tri(tridecyl)azanium Openeye Name: dioxido(dioxo)molybdenum; tri(tridecyl)ammonium CAS Name: dioxido(dioxo)molybdenum; tri(tridecyl)ammonium IUPAC Name: dioxido(dioxo)molybdenum; tri(tridecyl)azanium Traditional Name: diketo(dioxido)molybdenum; tri(tridecyl)ammonium Formula: C39H82Mo6NO24-11 MolecularWeight: 1524.70068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC[NH+](CCCCCCCCCCCCC)CCCCCCCCCCCCC.[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC[NH+](CCCCCCCCCCCCC)CCCCCCCCCCCCC.[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-].[O-][Mo](=O)(=O)[O-]

InChI

InChI=1S/C39H81N.6Mo.24O/c1-4-7-10-13-16-19-22-25-28-31-34-37-40(38-35-32-29-26-23-20-17-14-11-8-5-2)39-36-33-30-27-24-21-18-15-12-9-6-3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-39H2,1-3H3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;12*-1/p+1