Base information

Cat. No.
CAS No.808142-80-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C56H78F6IrN4P
Molecular Weight 1144.43
Exact Mass 1144.55
XLogP3 14.2252
Mr 298.477
PSA 129.54
Sequence -
Atom number 146
Bond number 153
Ring number 9
Rotor number 6
Residues number 0
Canonical smiles [F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=C2[CH-](=C1)[Ir+3]13([CH-]4=CC(=CC=C4C4=CC(=CC=N14)C(C)(C)C)C(C)(C)C)(N1=CC=C(C=C21)C(C)(C)C)N1=CC=C(C=C1C1=CC(=CC=N31)C(C)(C)C)C(C)(C)C)(C)C

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