barium(2+); phenylmethylbenzene

Systemtic Name: barium(2+); phenylmethylbenzene Openeye Name: barium(2+); phenylmethylbenzene CAS Name: barium(2+); phenylmethylbenzene IUPAC Name: barium(2+); phenylmethylbenzene Traditional Name: barium(2+); phenylmethylbenzene Formula: C26H22Ba MolecularWeight: 471.77988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.[Ba+2]

Isomeric SMILES

C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.[Ba+2]

InChI

InChI=1S/2C13H11.Ba/c2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;/h2*1-11H;/q2*-1;+2