2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride

Systemtic Name: 2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride Openeye Name: 2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride CAS Name: 2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride IUPAC Name: 2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride Traditional Name: 2-methyl-3-phenyl-4H-indeno[2,1-b]pyrrol-4-ide; zirconium(4+); dichloride Formula: C36H28Cl2N2Zr MolecularWeight: 650.75092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C3=CC=CC=C3)[CH-]C4=CC=CC=C42.CC1=CC2=C(N1C3=CC=CC=C3)[CH-]C4=CC=CC=C42.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CC2=C(N1C3=CC=CC=C3)[CH-]C4=CC=CC=C42.CC1=CC2=C(N1C3=CC=CC=C3)[CH-]C4=CC=CC=C42.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C18H14N.2ClH.Zr/c2*1-13-11-17-16-10-6-5-7-14(16)12-18(17)19(13)15-8-3-2-4-9-15;;;/h2*2-12H,1H3;2*1H;/q2*-1;;;+4/p-2