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(-)-1,2-Bis[(2R,5R)-dimethylphospholano]benzene(cyclooctadiene)rhodium(I) tetrafluoroborate

Catalog Number ACM210057231-1
CAS 210057-23-1
Structure (-)-1,2-Bis[(2R,5R)-dimethylphospholano]benzene(cyclooctadiene)rhodium(I) tetrafluoroborate
Synonyms (1Z,5Z)-Cycloocta-1,5-diene;(2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;tetrafluoroborate
Molecular Weight 604.3
Molecular Formula C26H40BF4P2Rh
Canonical SMILES [B-](F)(F)(F)F.CC1CCC(P1C2=CC=CC=C2P3C(CCC3C)C)C.C1CC=CCCC=C1.[Rh]
InChI InChI=1S/C18H28P2.C8H12.BF4.Rh/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h5-8,13-16H,9-12H2,1-4H3;1-2,7-8H,3-6H2;/q;-1;/t13-,14-,15-,16-;/m0/s1
InChI Key ZUMNNKGIZSDCBZ-MYDVBLLJSA-N
Purity 98%+
Appearance Crystal
Exact Mass 604.16894
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
Isomeric SMILES [B-](F)(F)(F)F.C[C@H]1CC[C@@H](P1C2=CC=CC=C2P3[C@H](CC[C@@H]3C)C)C.C1CC=CCCC=C1.[Rh]
Monoisotopic Mass 604.16894
Rotatable Bond Count 2
Topological Polar Surface Area 0 Ų

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