carbon monoxide; iridium; 1-(pyrazol-1-ylmethyl)pyrazole; tetraphenylboranuide

Systemtic Name: carbon monoxide; iridium; 1-(pyrazol-1-ylmethyl)pyrazole; tetraphenylboranuide Openeye Name: carbon monoxide; iridium; 1-(pyrazol-1-ylmethyl)pyrazole; tetraphenylboranuide CAS Name: carbon monoxide; iridium; 1-(1-pyrazolylmethyl)pyrazole; tetraphenylboranuide IUPAC Name: carbon monoxide; iridium; 1-(pyrazol-1-ylmethyl)pyrazole; tetraphenylboranuide Traditional Name: carbon monoxide; iridium; 1-(pyrazol-1-ylmethyl)pyrazole; tetraphenylboranuide Formula: C33H28BIrN4O2- MolecularWeight: 715.62902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[C-]#[O+].[C-]#[O+].C1=CN(N=C1)CN2C=CC=N2.[Ir]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[C-]#[O+].[C-]#[O+].C1=CN(N=C1)CN2C=CC=N2.[Ir]

InChI

InChI=1S/C24H20B.C7H8N4.2CO.Ir/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-8-10(5-1)7-11-6-2-4-9-11;2*1-2;/h1-20H;1-6H,7H2;;;/q-1;;;;