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1,1'-Bis(di-i-propylphosphino)ferrocene(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate

Catalog Number ACM157772651-1
CAS 157772-65-1
Structure 1,1'-Bis(di-i-propylphosphino)ferrocene(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate
Molecular Weight 716.2
Molecular Formula C30H48BF4FeP2Rh
Canonical SMILES [B-](F)(F)(F)F.CC(C)P([C]1[CH][CH][CH][CH]1)C(C)C.CC(C)P([C]1[CH][CH][CH][CH]1)C(C)C.C1CC=CCCC=C1.[Fe].[Rh]
InChI InChI=1S/2C11H18P.C8H12.BF4.Fe.Rh/c2*1-9(2)12(10(3)4)11-7-5-6-8-11;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h2*5-10H,1-4H3;1-2,7-8H,3-6H2;/q;-1;/b;2-1-,8-7-;
InChI Key JVIPKMKCCUWUIS-ISVFTUMHSA-N
Purity 98%
Appearance Powder
Exact Mass 716.16647
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
Isomeric SMILES [B-](F)(F)(F)F.CC(P(C(C)C)[C]1[CH][CH][CH][CH]1)C.CC(P(C(C)C)[C]1[CH][CH][CH][CH]1)C.C1/C=C\CC/C=C\C1.[Fe].[Rh]
Monoisotopic Mass 716.16647
Rotatable Bond Count 6
Topological Polar Surface Area 0 Ų

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