carbon monoxide; cyclopentane; molybdenum; prop-1-yne; tetrafluoroborate

Systemtic Name: carbon monoxide; cyclopentane; molybdenum; prop-1-yne; tetrafluoroborate Openeye Name: carbon monoxide; cyclopentane; molybdenum; prop-1-yne; tetrafluoroborate CAS Name: carbon monoxide; cyclopentane; molybdenum; 1-propyne; tetrafluoroborate IUPAC Name: carbon monoxide; cyclopentane; molybdenum; prop-1-yne; tetrafluoroborate Traditional Name: carbon monoxide; cyclopentane; molybdenum; prop-1-yne; tetrafluoroborate Formula: C17H13BF4Mo2O4 MolecularWeight: 559.967333

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[CH2+]C#C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Mo].[Mo]

Isomeric SMILES

[B-](F)(F)(F)F.[CH2+]C#C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Mo].[Mo]

InChI

InChI=1S/2C5H5.C3H3.4CO.BF4.2Mo/c2*1-2-4-5-3-1;1-3-2;4*1-2;2-1(3,4)5;;/h2*1-5H;1H,2H2;;;;;;;/q;;+1;;;;;-1;;