1-but-3-enyl-3-methyl-2H-imidazole; chloranyliridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate

Systemtic Name: 1-but-3-enyl-3-methyl-2H-imidazole; chloranyliridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate Openeye Name: 1-but-3-enyl-3-methyl-2H-imidazole; chloroiridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate CAS Name: 1-but-3-enyl-3-methyl-2H-imidazole; chloroiridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate IUPAC Name: 1-but-3-enyl-3-methyl-2H-imidazole; chloroiridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate Traditional Name: 1-but-3-enyl-3-methyl-4-imidazoline; chloroiridium(2+); 1,2,3,4,5-pentamethylcyclopentane; hexafluorophosphate Formula: C18H29ClF6IrN2P+ MolecularWeight: 646.07044

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Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.CN1CN(C=C1)CCC=C.F[P-](F)(F)(F)(F)F.Cl[Ir+2]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.CN1CN(C=C1)CCC=C.F[P-](F)(F)(F)(F)F.Cl[Ir+2]

InChI

InChI=1S/C10H15.C8H14N2.ClH.F6P.Ir/c1-6-7(2)9(4)10(5)8(6)3;1-3-4-5-10-7-6-9(2)8-10;;1-7(2,3,4,5)6;/h1-5H3;3,6-7H,1,4-5,8H2,2H3;1H;;/q;;;-1;+3/p-1