bis(propanoylamino)boron; 1H-inden-1-ide; zirconium(4+); dichloride

Systemtic Name: bis(propanoylamino)boron; 1H-inden-1-ide; zirconium(4+); dichloride Openeye Name: bis(propanoylamino)boron; 1H-inden-1-ide; zirconium(4+); dichloride CAS Name: bis(1-oxopropylamino)boron; 1H-inden-1-ide; zirconium(4+); dichloride IUPAC Name: bis(propanoylamino)boron; 1H-inden-1-ide; zirconium(4+); dichloride Traditional Name: dipropionamidoboron; 1H-inden-1-ide; zirconium(4+); dichloride Formula: C24H26BCl2N2O2Zr MolecularWeight: 547.41644

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Descriptors Computed from Structure

Canonical SMILES:

[B](NC(=O)CC)NC(=O)CC.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[B](NC(=O)CC)NC(=O)CC.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C9H7.C6H12BN2O2.2ClH.Zr/c2*1-2-5-9-7-3-6-8(9)4-1;1-3-5(10)8-7-9-6(11)4-2;;;/h2*1-7H;3-4H2,1-2H3,(H,8,10)(H,9,11);2*1H;/q2*-1;;;;+4/p-2