bis(chloranyl)zirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphane

Systemtic Name: bis(chloranyl)zirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphane Openeye Name: dichlorozirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphane CAS Name: dichlorozirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphine IUPAC Name: dichlorozirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphane Traditional Name: dichlorozirconium; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; triethylphosphine Formula: C28H44Cl2P2Zr MolecularWeight: 604.726482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCP(CC)CC.CCP(CC)CC.C1=CC=C(C=C1)C=CC=CC2=CC=CC=C2.Cl[Zr]Cl

Isomeric SMILES

CCP(CC)CC.CCP(CC)CC.C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2.Cl[Zr]Cl

InChI

InChI=1S/C16H14.2C6H15P.2ClH.Zr/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16;2*1-4-7(5-2)6-3;;;/h1-14H;2*4-6H2,1-3H3;2*1H;/q;;;;;+2/p-2/b13-7+,14-8+;;;;;