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Bis(cycloocta-1,5-diene)rhodium(I) hexafluorophosphate

Catalog Number ACM62793311-1
CAS 62793-31-1
Structure Bis(cycloocta-1,5-diene)rhodium(I) hexafluorophosphate
Synonyms (1Z,5Z)-Cycloocta-1,5-diene;rhodium;hexafluorophosphate
Molecular Weight 464.23
Molecular Formula C16H24F6PRh
Canonical SMILES C1CC=CCCC=C1.C1CC=CCCC=C1.F[P-](F)(F)(F)(F)F.[Rh]
InChI InChI=1S/2C8H12.F6P.Rh/c2*1-2-4-6-8-7-5-3-1;1-7(2,3,4,5)6;/h2*1-2,7-8H,3-6H2;/q;-1;/b2*2-1-,8-7-;
InChI Key LPYLNJHERBLCRN-QMDOQEJBSA-N
Purity 97%+
Exact Mass 464.05748
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 0
Isomeric SMILES C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.F[P-](F)(F)(F)(F)F.[Rh]
Monoisotopic Mass 464.05748
Rotatable Bond Count 0
Topological Polar Surface Area 0 Ų

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