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1,2-Bis((2R,5R)-2,5-diethylphospholano)ethane(cyclooctadiene)rhodium(I) tetrafluoroborate

Catalog Number ACM136705709-1
CAS 136705-70-9
Synonyms Cycloocta-1,5-diene;1-[2-(2,5-diethylphospholan-1-yl)ethyl]-2,5-diethylphospholane;rhodium;tetrafluoroborate
IUPAC Name carbanide;(1Z,5Z)-cycloocta-1,5-diene;1-[2-(2,5-diethylphospholan-1-ium-1-yl)ethyl]-2,5-diethylphospholan-1-ium;rhodium(3+);tetrafluoroborate;
Molecular Weight 612.3
Molecular Formula C26H48BF4P2Rh
Canonical SMILES [B-](F)(F)(F)F.CCC1CCC(P1CCP2C(CCC2CC)CC)CC.C1CC=CCCC=C1.[Rh]
InChI InChI=1S/C18H36P2.C8H12.BF4.Rh/c1-5-15-9-10-16(6-2)19(15)13-14-20-17(7-3)11-12-18(20)8-4;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h15-18H,5-14H2,1-4H3;1-2,7-8H,3-6H2;/q;-1;
InChI Key PJGNNLUCYADUOI-UHFFFAOYSA-N
Purity 98%
Appearance Solid
Complexity 325
Covalently-Bonded Unit Count 6
Exact Mass 612.23154
Formal Charge 2
Heavy Atom Count 36
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
Monoisotopic Mass 612.23154
Rotatable Bond Count 7
Topological Polar Surface Area 0 Ų

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