barium(2+); 1,2,5,5-tetramethyl-3-propyl-cyclopenta-1,3-diene

Systemtic Name: barium(2+); 1,2,5,5-tetramethyl-3-propyl-cyclopenta-1,3-diene Openeye Name: barium(2+); 1,2,5,5-tetramethyl-3-propyl-cyclopenta-1,3-diene CAS Name: barium(2+); 1,2,5,5-tetramethyl-3-propylcyclopenta-1,3-diene IUPAC Name: barium(2+); 1,2,5,5-tetramethyl-3-propylcyclopenta-1,3-diene Traditional Name: barium(2+); 1,2,5,5-tetramethyl-3-propyl-cyclopenta-1,3-diene Formula: C24H38Ba MolecularWeight: 463.88552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[C-]C(C(=C1C)C)(C)C.CCCC1=[C-]C(C(=C1C)C)(C)C.[Ba+2]

Isomeric SMILES

CCCC1=[C-]C(C(=C1C)C)(C)C.CCCC1=[C-]C(C(=C1C)C)(C)C.[Ba+2]

InChI

InChI=1S/2C12H19.Ba/c2*1-6-7-11-8-12(4,5)10(3)9(11)2;/h2*6-7H2,1-5H3;/q2*-1;+2