hafnium; [(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium

Systemtic Name: hafnium; [(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium Openeye Name: hafnium; [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium CAS Name: hafnium; [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxonium IUPAC Name: hafnium; [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxidanium Traditional Name: hafnium; [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium Formula: C45H39HfO6+3 MolecularWeight: 854.27756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.[Hf]

Isomeric SMILES

C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.[Hf]

InChI

InChI=1S/3C15H12O2.Hf/c3*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;/h3*1-11,16H;/p+3/b3*14-11-;