CID5245814 structure

CID5245814

dicopper;azanide;copper;copper(1+);3,6-dihydro-2H-pyridin-1-ide-3-sulfonic acid;tris(piperidin-1-ide-3-sulfonic acid);hexahydrate

CAS: 7229-08-5
Molecular Formula C20H52Cu5N5O18S4
Molecular Weight 1092.8671 g/mol
LogP -2.8264
Topological Polar Surface Area 496.38 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 8
Rotatable Bonds 4
Exact Mass 1092.8671
Monoisotopic Mass 1094.8652
Heavy Atoms 52
Complexity 1116.6166

Chemical Identifiers

CAS Number 7229-08-5
SMILES C1CC(C[N-]C1)S(=O)(=O)O.C1CC(C[N-]C1)S(=O)(=O)O.C1CC(C[N-]C1)S(=O)(=O)O.C1C=CC(C[N-]1)S(=O)(=O)O.[NH2-].O.O.O.O.O.O.[Cu].[Cu].[Cu+].[Cu+2].[Cu+2]

Product Overview

CID5245814 (CAS 7229-08-5), with molecular formula C20H52Cu5N5O18S4 and molecular weight 1092.8671 g/mol. IUPAC: dicopper;azanide;copper;copper(1+);3,6-dihydro-2H-pyridin-1-ide-3-sulfonic acid;tris(piperidin-1-ide-3-sulfonic acid);hexahydrate.

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