4-phenyl-2,6-dipropyl-cyclopenta[b]phosphole; zirconium(2+); dichloride

Systemtic Name: 4-phenyl-2,6-dipropyl-cyclopenta[b]phosphole; zirconium(2+); dichloride Openeye Name: 4-phenyl-2,6-dipropyl-cyclopenta[b]phosphole; zirconium(2+); dichloride CAS Name: 4-phenyl-2,6-dipropylcyclopenta[b]phosphole; zirconium(2+); dichloride IUPAC Name: 4-phenyl-2,6-dipropylcyclopenta[b]phosphole; zirconium(2+); dichloride Traditional Name: 4-phenyl-2,6-dipropyl-cyclopenta[b]phosphole; zirconium(2+); dichloride Formula: C38H42Cl2P2Zr MolecularWeight: 722.817602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C2C1=PC(=C2)CCC)C3=CC=CC=C3.CCCC1=CC(=C2C1=PC(=C2)CCC)C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCCC1=CC(=C2C1=PC(=C2)CCC)C3=CC=CC=C3.CCCC1=CC(=C2C1=PC(=C2)CCC)C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C19H21P.2ClH.Zr/c2*1-3-8-15-12-17(14-10-6-5-7-11-14)18-13-16(9-4-2)20-19(15)18;;;/h2*5-7,10-13H,3-4,8-9H2,1-2H3;2*1H;/q;;;;+2/p-2