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Trans-carbonylchlorobis(triphenylphosphine)rhodium(I)

Catalog Number ACM15318339
CAS 15318-33-9
Synonyms Chlororuthenium(1+);methanone;triphenylphosphane
Molecular Weight 690.1
Molecular Formula C37H31ClOP2Ru
Canonical SMILES [CH-]=O.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.Cl[Ru+]
InChI InChI=1S/2C18H15P.CHO.ClH.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;/h2*1-15H;1H;1H;/q;-1;+2/p-1
InChI Key JWLZITTXJFFUGG-UHFFFAOYSA-M
Purity 97%
Complexity 210
Covalently-Bonded Unit Count 4
Defined Atom Stereocenter Count 0
Exact Mass 690.058208
Heavy Atom Count 42
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
Monoisotopic Mass 690.058208
Rotatable Bond Count 6
Topological Polar Surface Area 17.1 Ų

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