carbanide; cyclopenta-1,3-diene; phenylazanylboranylidenezirconium; dichloride

Systemtic Name: carbanide; cyclopenta-1,3-diene; phenylazanylboranylidenezirconium; dichloride Openeye Name: anilinoboranylidenezirconium; carbanide; cyclopenta-1,3-diene; dichloride CAS Name: anilinoboranylidenezirconium; carbanide; cyclopenta-1,3-diene; dichloride IUPAC Name: anilinoboranylidenezirconium; carbanide; cyclopenta-1,3-diene; dichloride Traditional Name: anilinoboranylidenezirconium; carbanide; cyclopenta-1,3-diene; dichloride Formula: C17H19BCl2NZr-5 MolecularWeight: 410.28046

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Descriptors Computed from Structure

Canonical SMILES:

B(=[Zr])NC1=CC=CC=C1.[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-]

Isomeric SMILES

B(=[Zr])NC1=CC=CC=C1.[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-]

InChI

InChI=1S/C6H6BN.2C5H5.CH3.2ClH.Zr/c7-8-6-4-2-1-3-5-6;2*1-2-4-5-3-1;;;;/h1-5,8H;2*1-3H,4H2;1H3;2*1H;/q;3*-1;;;/p-2