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Tris(3,5-dimethyl-1H-pyrazolato)hydroborato bis(triphenylphosphine)rhodium(I) toluene adduct

Catalog Number ACM341483769-1
CAS 341483-76-9
Molecular Weight 923.7
Molecular Formula C51H51BN6P2Rh
Canonical SMILES [B-](N1C(=CC(=N1)C)C)(N2C(=CC(=N2)C)C)N3C(=CC(=N3)C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Rh]
InChI InChI=1S/2C18H15P.C15H21BN6.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-10-7-13(4)20(17-10)16(21-14(5)8-11(2)18-21)22-15(6)9-12(3)19-22;/h2*1-15H;7-9H,1-6H3;/q;-1;
InChI Key IZJZVPVHBUIFCC-UHFFFAOYSA-N
Purity 99%
Appearance Red crystal
Complexity 541
Covalently-Bonded Unit Count 4
Defined Atom Stereocenter Count 0
Exact Mass 923.27984
Heavy Atom Count 61
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
Monoisotopic Mass 923.27984
Rotatable Bond Count 9
Topological Polar Surface Area 53.5 Ų

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