(1Z,5Z)-cycloocta-1,5-diene; ethanenitrile; rhodium; tetrafluoroborate

Systemtic Name: (1Z,5Z)-cycloocta-1,5-diene; ethanenitrile; rhodium; tetrafluoroborate Openeye Name: acetonitrile; (1Z,5Z)-cycloocta-1,5-diene; rhodium; tetrafluoroborate CAS Name: acetonitrile; (1Z,5Z)-cycloocta-1,5-diene; rhodium; tetrafluoroborate IUPAC Name: acetonitrile; (1Z,5Z)-cycloocta-1,5-diene; rhodium; tetrafluoroborate Traditional Name: acetonitrile; (1Z,5Z)-cycloocta-1,5-diene; rhodium; tetrafluoroborate Formula: C12H18BF4N2Rh- MolecularWeight: 379.994833

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC#N.CC#N.C1CC=CCCC=C1.[Rh]

Isomeric SMILES

[B-](F)(F)(F)F.CC#N.CC#N.C1/C=C\CC/C=C\C1.[Rh]

InChI

InChI=1S/C8H12.2C2H3N.BF4.Rh/c1-2-4-6-8-7-5-3-1;2*1-2-3;2-1(3,4)5;/h1-2,7-8H,3-6H2;2*1H3;;/q;;;-1;/b2-1-,8-7-;;;;