chloranylpalladium(1+); ditert-butyl-[[2-(ditert-butylphosphaniumylmethyl)phenyl]methyl]phosphanium; propan-1-one

Systemtic Name: chloranylpalladium(1+); ditert-butyl-[[2-(ditert-butylphosphaniumylmethyl)phenyl]methyl]phosphanium; propan-1-one Openeye Name: chloropalladium(1+); ditert-butyl-[[2-(ditert-butylphosphaniumylmethyl)phenyl]methyl]phosphonium; propan-1-one CAS Name: chloropalladium(1+); ditert-butyl-[[2-(ditert-butylphosphiniumylmethyl)phenyl]methyl]phosphonium; 1-propanone IUPAC Name: chloropalladium(1+); ditert-butyl-[[2-(ditert-butylphosphaniumylmethyl)phenyl]methyl]phosphanium; propan-1-one Traditional Name: chloropalladium(1+); ditert-butyl-[2-(ditert-butylphosphiniumylmethyl)benzyl]phosphonium; propan-1-one Formula: C27H51ClOP2Pd+2 MolecularWeight: 595.513762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[C-]=O.CC(C)(C)[PH+](CC1=CC=CC=C1C[PH+](C(C)(C)C)C(C)(C)C)C(C)(C)C.Cl[Pd+]

Isomeric SMILES

CC[C-]=O.CC(C)(C)[PH+](CC1=CC=CC=C1C[PH+](C(C)(C)C)C(C)(C)C)C(C)(C)C.Cl[Pd+]

InChI

InChI=1S/C24H44P2.C3H5O.ClH.Pd/c1-21(2,3)25(22(4,5)6)17-19-15-13-14-16-20(19)18-26(23(7,8)9)24(10,11)12;1-2-3-4;;/h13-16H,17-18H2,1-12H3;2H2,1H3;1H;/q;-1;;+2/p+1