cyclopenta-1,3-diene; N,N-diethylethanamine; dioctylazanide; titanium(2+)

Systemtic Name: cyclopenta-1,3-diene; N,N-diethylethanamine; dioctylazanide; titanium(2+) Openeye Name: cyclopenta-1,3-diene; N,N-diethylethanamine; dioctylazanide; titanium(2+) CAS Name: cyclopenta-1,3-diene; N,N-diethylethanamine; dioctylazanide; titanium(2+) IUPAC Name: cyclopenta-1,3-diene; N,N-diethylethanamine; dioctylazanide; titanium(2+) Traditional Name: cyclopenta-1,3-diene; dioctylazanide; titanium(2+); triethylamine Formula: C59H121N4Ti-3 MolecularWeight: 934.48584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N-]CCCCCCCC.CCCCCCCC[N-]CCCCCCCC.CCCCCCCC[N-]CCCCCCCC.CCN(CC)C[CH2-].C1C=CC=[C-]1.[Ti+2]

Isomeric SMILES

CCCCCCCC[N-]CCCCCCCC.CCCCCCCC[N-]CCCCCCCC.CCCCCCCC[N-]CCCCCCCC.CCN(CC)C[CH2-].C1C=CC=[C-]1.[Ti+2]

InChI

InChI=1S/3C16H34N.C6H14N.C5H5.Ti/c3*1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2;1-4-7(5-2)6-3;1-2-4-5-3-1;/h3*3-16H2,1-2H3;1,4-6H2,2-3H3;1-3H,4H2;/q5*-1;+2