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Bis(2,2'-bipyridine)-(5-aminophenanthroline)ruthenium bis(hexafluorophosphate)

Catalog Number ACM84537860-2
CAS 84537-86-0
Synonyms Ru(bpy)2(phen-5-NH2)(PF6)2
IUPAC Name 1,10-phenanthrolin-5-amine;2-pyridin-2-ylpyridine;ruthenium(2+);dihexafluorophosphate
Molecular Weight 898.59
Molecular Formula C32H25F12N7P2Ru
InChI InChI=1S/C12H9N3.2C10H8N2.2F6P.Ru/c13-10-7-8-3-1-5-14-11(8)12-9(10)4-2-6-15-12;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*1-7(2,3,4,5)6;/h1-7H,13H2;2*1-8H;;;/q;;;2*-1;+2
InChI Key QQMMCXKCYXQNNA-UHFFFAOYSA-N
Complexity 414
Exact Mass 899.049846 g/mol
Formal Charge 0
Heavy Atom Count 54
Hydrogen Bond Acceptor Count 21
Hydrogen Bond Donor Count 1
Isomeric SMILES C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC2=CC(=C3C=CC=NC3=C2N=C1)N.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2]
Monoisotopic Mass 899.049846 g/mol
Rotatable Bond Count 2
Topological Polar Surface Area 103Ų

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