cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+); dichloride

Systemtic Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+); dichloride Openeye Name: cyclopenta-1,3-diene; isopropylidenetitanium(1+); phenol; dichloride CAS Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+); dichloride IUPAC Name: cyclopenta-1,3-diene; phenol; propan-2-ylidenetitanium(1+); dichloride Traditional Name: cyclopenta-1,3-diene; isopropylidenetitanium(1+); phenol; dichloride Formula: C14H17Cl2OTi-2 MolecularWeight: 320.05718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Ti+])C.C1C=CC=[C-]1.C1=CC=C(C=C1)O.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Ti+])C.C1C=CC=[C-]1.C1=CC=C(C=C1)O.[Cl-].[Cl-]

InChI

InChI=1S/C6H6O.C5H5.C3H6.2ClH.Ti/c7-6-4-2-1-3-5-6;1-2-4-5-3-1;1-3-2;;;/h1-5,7H;1-3H,4H2;1-2H3;2*1H;/q;-1;;;;+1/p-2