cyclopenta-1,4-dien-1-yl(diphenyl)borane; hafnium(4+); 2-oxidanylprop-2-enoate

Systemtic Name: cyclopenta-1,4-dien-1-yl(diphenyl)borane; hafnium(4+); 2-oxidanylprop-2-enoate Openeye Name: cyclopenta-1,4-dien-1-yl(diphenyl)borane; hafnium(4+); 2-hydroxyprop-2-enoate CAS Name: 1-cyclopenta-1,4-dienyl(diphenyl)borane; hafnium(4+); 2-hydroxy-2-propenoate IUPAC Name: cyclopenta-1,4-dien-1-yl(diphenyl)borane; hafnium(4+); 2-hydroxyprop-2-enoate Traditional Name: cyclopenta-1,4-dien-1-yl(diphenyl)borane; hafnium(4+); 2-hydroxyacrylate Formula: C40H34B2HfO6 MolecularWeight: 810.80636

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=[C-]CC=C3.B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=[C-]CC=C3.C=C(C(=O)[O-])O.C=C(C(=O)[O-])O.[Hf+4]

Isomeric SMILES

B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=[C-]CC=C3.B(C1=CC=CC=C1)(C2=CC=CC=C2)C3=[C-]CC=C3.C=C(C(=O)[O-])O.C=C(C(=O)[O-])O.[Hf+4]

InChI

InChI=1S/2C17H14B.2C3H4O3.Hf/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;2*1-2(4)3(5)6;/h2*1-7,9-13H,8H2;2*4H,1H2,(H,5,6);/q2*-1;;;+4/p-2