copper 1,10-phenanthroline-1,10-diide hydrate

Systemtic Name: copper 1,10-phenanthroline-1,10-diide hydrate Openeye Name: copper 1,10-phenanthroline-1,10-diide hydrate CAS Name: copper 1,10-phenanthroline-1,10-diide hydrate IUPAC Name: copper 1,10-phenanthroline-1,10-diide hydrate Traditional Name: cupric 1,10-phenanthroline-1,10-diide hydrate Formula: C24H18CuN4O-2 MolecularWeight: 441.97192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.O.[Cu+2]

Isomeric SMILES

C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.C1=C[N-]C2=C3C(=CC=C[N-]3)C=CC2=C1.O.[Cu+2]

InChI

InChI=1S/2C12H8N2.Cu.H2O/c2*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;/h2*1-8H;;1H2/q2*-2;+2;