cyclopenta-1,3-diene; methylidenetitanium(1+); 3-phenylphenol; dichloride

Systemtic Name: cyclopenta-1,3-diene; methylidenetitanium(1+); 3-phenylphenol; dichloride Openeye Name: cyclopenta-1,3-diene; methylenetitanium(1+); 3-phenylphenol; dichloride CAS Name: cyclopenta-1,3-diene; methylenetitanium(1+); 3-phenylphenol; dichloride IUPAC Name: cyclopenta-1,3-diene; methylidenetitanium(1+); 3-phenylphenol; dichloride Traditional Name: cyclopenta-1,3-diene; methylenetitanium(1+); 3-phenylphenol; dichloride Formula: C18H17Cl2OTi-2 MolecularWeight: 368.09998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=[Ti+].C1C=CC=[C-]1.C1=CC=C(C=C1)C2=CC(=CC=C2)O.[Cl-].[Cl-]

Isomeric SMILES

C=[Ti+].C1C=CC=[C-]1.C1=CC=C(C=C1)C2=CC(=CC=C2)O.[Cl-].[Cl-]

InChI

InChI=1S/C12H10O.C5H5.CH2.2ClH.Ti/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10;1-2-4-5-3-1;;;;/h1-9,13H;1-3H,4H2;1H2;2*1H;/q;-1;;;;+1/p-2