2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride

Systemtic Name: 2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride Openeye Name: 2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; isopropylidenezirconium; dichloride CAS Name: 2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride IUPAC Name: 2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; propan-2-ylidenezirconium; dichloride Traditional Name: 2-butylcyclopenta[b]pyrrole; cyclopenta-1,3-diene; isopropylidenezirconium; dichloride Formula: C19H24Cl2NZr-3 MolecularWeight: 428.53056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC2=N1.CC(=[Zr])C.C1C=CC=[C-]1.[Cl-].[Cl-]

Isomeric SMILES

CCCCC1=CC2=CC=CC2=N1.CC(=[Zr])C.C1C=CC=[C-]1.[Cl-].[Cl-]

InChI

InChI=1S/C11H13N.C5H5.C3H6.2ClH.Zr/c1-2-3-6-10-8-9-5-4-7-11(9)12-10;1-2-4-5-3-1;1-3-2;;;/h4-5,7-8H,2-3,6H2,1H3;1-3H,4H2;1-2H3;2*1H;/q;-1;;;;/p-2