carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+)

Systemtic Name: carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+) Openeye Name: carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+) CAS Name: carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+) IUPAC Name: carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+) Traditional Name: carbanide; cyclopenta-1,3-diene; 1,9-dihydrofluoren-1-ide; 1H-inden-1-ide; zirconium(4+) Formula: C60H60Zr3 MolecularWeight: 1054.7904

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Zr+4].[Zr+4].[Zr+4]

Isomeric SMILES

[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Zr+4].[Zr+4].[Zr+4]

InChI

InChI=1S/2C13H9.2C9H7.2C5H5.6CH3.3Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-2-5-9-7-3-6-8(9)4-1;2*1-2-4-5-3-1;;;;;;;;;/h2*1-5,7-8H,9H2;2*1-7H;2*1-3H,4H2;6*1H3;;;/q12*-1;3*+4