cyclooctane; (1-isoquinolin-1-ylnaphthalen-2-yl)-diphenyl-phosphane; rhodium; tetrafluoroborate

Systemtic Name: cyclooctane; (1-isoquinolin-1-ylnaphthalen-2-yl)-diphenyl-phosphane; rhodium; tetrafluoroborate Openeye Name: cyclooctane; [1-(1-isoquinolyl)-2-naphthyl]-diphenyl-phosphane; rhodium; tetrafluoroborate CAS Name: cyclooctane; [1-(1-isoquinolinyl)-2-naphthalenyl]-diphenylphosphine; rhodium; tetrafluoroborate IUPAC Name: cyclooctane; (1-isoquinolin-1-ylnaphthalen-2-yl)-diphenylphosphane; rhodium; tetrafluoroborate Traditional Name: cyclooctane; [1-(1-isoquinolyl)-2-naphthyl]-diphenyl-phosphine; rhodium; tetrafluoroborate Formula: C39H34BF4NPRh- MolecularWeight: 737.377834

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1C[CH][CH]CC[CH][CH]1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=NC=CC6=CC=CC=C65.[Rh]

Isomeric SMILES

[B-](F)(F)(F)F.C1C[CH][CH]CC[CH][CH]1.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=NC=CC6=CC=CC=C65.[Rh]

InChI

InChI=1S/C31H22NP.C8H12.BF4.Rh/c1-3-13-25(14-4-1)33(26-15-5-2-6-16-26)29-20-19-23-11-7-9-17-27(23)30(29)31-28-18-10-8-12-24(28)21-22-32-31;1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h1-22H;1-2,7-8H,3-6H2;;/q;;-1;