copper(1+); methylbenzene; 1,3,5-trimethylbenzene-6-ide

Systemtic Name: copper(1+); methylbenzene; 1,3,5-trimethylbenzene-6-ide Openeye Name: pentacuprous; toluene; 1,3,5-trimethylbenzene-6-ide CAS Name: copper(1+); toluene; 1,3,5-trimethylbenzene-6-ide IUPAC Name: copper(1+); toluene; 1,3,5-trimethylbenzene-6-ide Traditional Name: pentacuprous; toluene; 1,3,5-trimethylbenzene-6-ide Formula: C52H63Cu5 MolecularWeight: 1005.78662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.[Cu+].[Cu+].[Cu+].[Cu+].[Cu+]

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.CC1=CC(=[C-]C(=C1)C)C.[Cu+].[Cu+].[Cu+].[Cu+].[Cu+]

InChI

InChI=1S/5C9H11.C7H8.5Cu/c5*1-7-4-8(2)6-9(3)5-7;1-7-5-3-2-4-6-7;;;;;/h5*4-5H,1-3H3;2-6H,1H3;;;;;/q5*-1;;5*+1