MolDB6 demo: details for selected entry

cobalt(2+);dinitrate (23203)
hit structure

FormulaH3CoN2O6
MW185.97
InChIKeyUFMZWBIQTDUYBN-UHFFFAOYSA-N
pubchem_compound_cid25000
pubchem_compound_canonicalized1
pubchem_cactvs_complexity19
pubchem_cactvs_hbond_acceptor6
pubchem_cactvs_hbond_donor0
pubchem_cactvs_rotatable_bond0
pubchem_cactvs_subskeysAAADcQADOAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAAAAAAAAAAQAABAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
pubchem_iupac_openeye_namecobaltous;dinitrate
pubchem_iupac_cas_namecobalt(2+);dinitrate
pubchem_iupac_systematic_namecobalt(2+);dinitrate
pubchem_iupac_traditional_namecobaltous;dinitrate
pubchem_iupac_inchiInChI=1S/Co.2NO3/c;2*2-1(3)4/q+2;2*-1
pubchem_iupac_inchikeyUFMZWBIQTDUYBN-UHFFFAOYSA-N
pubchem_xlogp3_aa0
pubchem_exact_mass182.908831
pubchem_molecular_formulaCoN2O6
pubchem_molecular_weight182.942995
pubchem_openeye_can_smiles[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Co+2]
pubchem_openeye_iso_smiles[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Co+2]
pubchem_cactvs_tpsa126
pubchem_monoisotopic_weight182.908831
pubchem_total_charge0
pubchem_heavy_atom_count9
pubchem_atom_def_stereo_count0
pubchem_atom_udef_stereo_count0
pubchem_bond_def_stereo_count0
pubchem_bond_udef_stereo_count0
pubchem_isotopic_atom_count0
pubchem_component_count3
pubchem_cactvs_tauto_count1
pubchem_coordinate_type1
pubchem_xlogp30