2-methylpropanoylazanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride

Systemtic Name: 2-methylpropanoylazanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride Openeye Name: 2-methylpropanoylazanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride CAS Name: (2-methyl-1-oxopropyl)azanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride IUPAC Name: 2-methylpropanoylazanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride Traditional Name: isobutyrylazanide; 1,2,3,5-tetramethylcyclopenta-1,3-diene; zirconium(4+); dichloride Formula: C13H21Cl2NOZr MolecularWeight: 369.44194

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Descriptors Computed from Structure

Canonical SMILES:

CC1[C-]=C(C(=C1C)C)C.CC(C)C(=O)[NH-].[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1[C-]=C(C(=C1C)C)C.CC(C)C(=O)[NH-].[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C9H13.C4H9NO.2ClH.Zr/c1-6-5-7(2)9(4)8(6)3;1-3(2)4(5)6;;;/h6H,1-4H3;3H,1-2H3,(H2,5,6);2*1H;/q-1;;;;+4/p-3