Base information

Cat. No.
CAS No.1195511-56-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C71H56BF24IrNOP
Molecular Weight 1629.17
Exact Mass 1629.34
XLogP3 21.9198
Mr 335.429
PSA 46.67
Sequence -
Atom number 156
Bond number 169
Ring number 15
Rotor number 16
Residues number 0
Canonical smiles c1ccc(cc1)C[C@H]1COC2=N1[Ir+]134(C5=C4CCC1=C3CC5)P(c1ccccc1)(c1ccccc1)C1=CCC[C@@]31C2=CCC3.FC(C1=C[CH-](=CC(=C1)C(F)(F)F)[B+3]([CH-]1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)([CH-]1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)[CH-]1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(F)F

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