tert-butylazanide; cyclopenta-1,3-dien-1-ylbenzene; propane; titanium(3+); dichloride

Systemtic Name: tert-butylazanide; cyclopenta-1,3-dien-1-ylbenzene; propane; titanium(3+); dichloride Openeye Name: tert-butylazanide; cyclopenta-1,3-dien-1-ylbenzene; propane; titanium(3+); dichloride CAS Name: tert-butylazanide; 1-cyclopenta-1,3-dienylbenzene; propane; titanium(3+); dichloride IUPAC Name: tert-butylazanide; cyclopenta-1,3-dien-1-ylbenzene; propane; titanium(3+); dichloride Traditional Name: tert-butylazanide; cyclopenta-1,3-dien-1-ylbenzene; propane; titanium(3+); dichloride Formula: C18H26Cl2NTi-2 MolecularWeight: 375.17874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C.CC(C)(C)[NH-].C1C=CC=C1C2=CC=CC=[C-]2.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

C[CH-]C.CC(C)(C)[NH-].C1C=CC=C1C2=CC=CC=[C-]2.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C11H9.C4H10N.C3H7.2ClH.Ti/c1-2-6-10(7-3-1)11-8-4-5-9-11;1-4(2,3)5;1-3-2;;;/h1-6,8H,9H2;5H,1-3H3;3H,1-2H3;2*1H;/q3*-1;;;+3/p-2