carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate

Systemtic Name: carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate Openeye Name: carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate CAS Name: carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate IUPAC Name: carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate Traditional Name: carbon monoxide; manganese; 1-methoxy-4-(2-phenylethynyl)benzene; tetrafluoroborate Formula: C18H12BF4MnO4- MolecularWeight: 434.028142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=CC=C(C=C1)C#CC2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mn]

Isomeric SMILES

[B-](F)(F)(F)F.COC1=CC=C(C=C1)C#CC2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mn]

InChI

InChI=1S/C15H12O.3CO.BF4.Mn/c1-16-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13;3*1-2;2-1(3,4)5;/h2-6,9-12H,1H3;;;;;/q;;;;-1;