AI56027
75777-87-6 | Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
Manufacturer: A2B Chem
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CatalogNumber
AI56027
ChemicalName
Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
CasNumber
75777-87-6
MolecularFormula
C54H72F12N6P2Ru
MolecularWeight
1196.1880404000008
MdlNumber
MFCD12022556
Smiles
[F-][P+5]([F-])([F-])([F-])([F-])[F-].[F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=[N]2C(=C1)C1=[N]([Ru+2]342([N]2=CC=C(C=C2C2=[N]4C=CC(=C2)C(C)(C)C)C(C)(C)C)[N]2=CC=C(C=C2C2=[N]3C=CC(=C2)C(C)(C)C)C(C)(C)C)C=CC(=C1)C(C)(C)C)(C)C
Complexity
341
Covalently-bondedUnitCount
6
FormalCharge
1
HeavyAtomCount
75
HydrogenBondAcceptorCount
20
RotatableBondCount
9
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CatalogNumber: AI56027
ChemicalName: Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
CasNumber: 75777-87-6
MolecularFormula: C54H72F12N6P2Ru
MolecularWeight: 1196.1880404000008
MdlNumber: MFCD12022556
Smiles: [F-][P+5]([F-])([F-])([F-])([F-])[F-].[F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=[N]2C(=C1)C1=[N]([Ru+2]342([N]2=CC=C(C=C2C2=[N]4C=CC(=C2)C(C)(C)C)C(C)(C)C)[N]2=CC=C(C=C2C2=[N]3C=CC(=C2)C(C)(C)C)C(C)(C)C)C=CC(=C1)C(C)(C)C)(C)C
Complexity: 341
Covalently-bondedUnitCount: 6
FormalCharge: 1
HeavyAtomCount: 75
HydrogenBondAcceptorCount: 20
RotatableBondCount: 9
CatalogNumber:
AI56027
ChemicalName:
Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
CasNumber:
75777-87-6
MolecularFormula:
C54H72F12N6P2Ru
MolecularWeight:
1196.1880404000008
MdlNumber:
MFCD12022556
Smiles:
[F-][P+5]([F-])([F-])([F-])([F-])[F-].[F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=[N]2C(=C1)C1=[N]([Ru+2]342([N]2=CC=C(C=C2C2=[N]4C=CC(=C2)C(C)(C)C)C(C)(C)C)[N]2=CC=C(C=C2C2=[N]3C=CC(=C2)C(C)(C)C)C(C)(C)C)C=CC(=C1)C(C)(C)C)(C)C
Complexity:
341
Covalently-bondedUnitCount:
6
FormalCharge:
1
HeavyAtomCount:
75
HydrogenBondAcceptorCount:
20
RotatableBondCount:
9
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Smiles: [O-][N+](=O)c1cc(C)c2c(c1)cn[nH]2
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[O-][N+](=O)c1cc(C)c2c(c1)cn[nH]2
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NCCS(=O)(=O)N=[N+]=[N-]
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Smiles: COC(=O)[C@H]1NCC[C@H]1O.Cl
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COC(=O)[C@H]1NCC[C@H]1O.Cl
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