chloranylrhenium; [(Z)-2-diphenylphosphanylethenyl]-diphenyl-phosphane; oxoazanide; tetrafluoroborate

Systemtic Name: chloranylrhenium; [(Z)-2-diphenylphosphanylethenyl]-diphenyl-phosphane; oxoazanide; tetrafluoroborate Openeye Name: chlororhenium; [(Z)-2-diphenylphosphanylvinyl]-diphenyl-phosphane; nitroxyl anion; tetrafluoroborate CAS Name: chlororhenium; [(Z)-2-diphenylphosphinoethenyl]-diphenylphosphine; nitroxyl anion; tetrafluoroborate IUPAC Name: chlororhenium; [(Z)-2-diphenylphosphanylethenyl]-diphenylphosphane; nitroxyl anion; tetrafluoroborate Traditional Name: chlororhenium; [(Z)-2-diphenylphosphinovinyl]-diphenyl-phosphine; nitroxyl anion; tetrafluoroborate Formula: C52H44BClF4NOP4Re-2 MolecularWeight: 1131.271517

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)P(C=CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(C=CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[N-]=O.Cl[Re]

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)P(C2=CC=CC=C2)/C=C\P(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)P(C2=CC=CC=C2)/C=C\P(C3=CC=CC=C3)C4=CC=CC=C4.[N-]=O.Cl[Re]

InChI

InChI=1S/2C26H22P2.BF4.ClH.NO.Re/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2-1(3,4)5;;1-2;/h2*1-22H;;1H;;/q;;-1;;-1;+1/p-1/b2*22-21-;;;;