bis(iodanyl)palladium; 1-methyl-3-[(1S,2S)-2-(3-methylbenzimidazol-1-yl)cyclohexyl]benzimidazole

Systemtic Name: bis(iodanyl)palladium; 1-methyl-3-[(1S,2S)-2-(3-methylbenzimidazol-1-yl)cyclohexyl]benzimidazole Openeye Name: diiodopalladium; 1-methyl-3-[(1S,2S)-2-(3-methylbenzimidazol-1-yl)cyclohexyl]benzimidazole CAS Name: diiodopalladium; 1-methyl-3-[(1S,2S)-2-(3-methyl-1-benzimidazolyl)cyclohexyl]benzimidazole IUPAC Name: diiodopalladium; 1-methyl-3-[(1S,2S)-2-(3-methylbenzimidazol-1-yl)cyclohexyl]benzimidazole Traditional Name: diiodopalladium; 1-methyl-3-[(1S,2S)-2-(3-methylbenzimidazol-1-yl)cyclohexyl]benzimidazole Formula: C44H48I4N8Pd2 MolecularWeight: 1409.3634

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Descriptors Computed from Structure

Canonical SMILES:

CN1[C]N(C2=CC=CC=C21)C3CCCCC3N4[C]N(C5=CC=CC=C54)C.CN1[C]N(C2=CC=CC=C21)C3CCCCC3N4[C]N(C5=CC=CC=C54)C.[Pd](I)I.[Pd](I)I

Isomeric SMILES

CN1[C]N(C2=CC=CC=C21)[C@H]3CCCC[C@@H]3N4[C]N(C5=CC=CC=C54)C.CN1[C]N(C2=CC=CC=C21)[C@H]3CCCC[C@@H]3N4[C]N(C5=CC=CC=C54)C.[Pd](I)I.[Pd](I)I

InChI

InChI=1S/2C22H24N4.4HI.2Pd/c2*1-23-15-25(19-11-5-3-9-17(19)23)21-13-7-8-14-22(21)26-16-24(2)18-10-4-6-12-20(18)26;;;;;;/h2*3-6,9-12,21-22H,7-8,13-14H2,1-2H3;4*1H;;/q;;;;;;2*+2/p-4/t2*21-,22-;;;;;;/m00....../s1