Molecule ID: 91825660

IUPAC Name: azane;chloroplatinum(1+);hexane-1,6-diamine;platinum(2+);tetranitrate

Description: The molecule is a trinuclear platinum coordination entity that is the tetranitrate salt of triplatin. It has a role as an antineoplastic agent. It is a platinum coordination entity and an organic nitrate salt. It contains a triplatin(4+).

SMILES: N.N.N.N.N.N.NCCCCCCN.NCCCCCCN.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cl-].[Cl-].[Pt+2].[Pt+2].[Pt+2]

SELFIES: [N].[N].[N].[N].[N].[N].[N][C][C][C][C][C][C][N].[N][C][C][C][C][C][C][N].[O][=N+1][Branch1][C][O-1][O-1].[O][=N+1][Branch1][C][O-1][O-1].[O][=N+1][Branch1][C][O-1][O-1].[O][=N+1][Branch1][C][O-1][O-1].[Cl-1].[Cl-1].[Pt+2].[Pt+2].[Pt+2]

InChI: InChI=1S/2C6H16N2.2ClH.4NO3.6H3N.3Pt/c2*7-5-3-1-2-4-6-8;;;4*2-1(3)4;;;;;;;;;/h2*1-8H2;2*1H;;;;;6*1H3;;;/q;;;;4*-1;;;;;;;3*+2/p-2

Molecular Properties:
- Polar Surface Area: 362.0 Ų
- LogP: nan