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50525-27-4 | Tris(2,2'-bipyridyl)ruthenium(II) chloride hexahydrate
CAS No: 50525-27-4 Catalog No: AG00396H MDL No:MFCD00149670
Product Description
Catalog Number:
AG00396H
Chemical Name:
Tris(2,2'-bipyridyl)ruthenium(II) chloride hexahydrate
CAS Number:
50525-27-4
Molecular Formula:
C30H36Cl2N6O6Ru
Molecular Weight:
748.6194
MDL Number:
MFCD00149670
IUPAC Name:
2-pyridin-2-ylpyridine;ruthenium(2+);dichloride;hexahydrate
InChI:
InChI=1S/3C10H8N2.2ClH.6H2O.Ru/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;;;;;;;/h3*1-8H;2*1H;6*1H2;/q;;;;;;;;;;;+2/p-2
InChI Key:
WHELTKFSBJNBMQ-UHFFFAOYSA-L
SMILES:
c1ccc(nc1)c1ccccn1.c1ccc(nc1)c1ccccn1.c1ccc(nc1)c1ccccn1.[Cl-].[Cl-].[Ru+2].O.O.O.O.O.O
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
12
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
748.112g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
748.624g/mol
Monoisotopic Mass:
748.112g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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