2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; propa-1,2-diene; 2H-pyridin-1-ide

Systemtic Name: 2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; propa-1,2-diene; 2H-pyridin-1-ide Openeye Name: allene; 2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; 2H-pyridin-1-ide CAS Name: 2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; propa-1,2-diene; 2H-pyridin-1-ide IUPAC Name: 2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; propa-1,2-diene; 2H-pyridin-1-ide Traditional Name: allene; 2,3-dimethanidylbuta-1,3-diene; iridium; pentane-2,4-diol; 2H-pyridin-1-ide Formula: C19H29IrNO2-4 MolecularWeight: 495.65606

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)O)O.[CH2-]C(=C)C(=C)[CH2-].C=C=[CH-].C1C=CC=C[N-]1.[Ir]

Isomeric SMILES

CC(CC(C)O)O.[CH2-]C(=C)C(=C)[CH2-].C=C=[CH-].C1C=CC=C[N-]1.[Ir]

InChI

InChI=1S/C6H8.C5H6N.C5H12O2.C3H3.Ir/c1-5(2)6(3)4;1-2-4-6-5-3-1;1-4(6)3-5(2)7;1-3-2;/h1-4H2;1-4H,5H2;4-7H,3H2,1-2H3;1H,2H2;/q-2;-1;;-1;