583844-38-6
Product Name:
((4S,5S)-(-)-O-[1-BENZYL-1-(5-METHYL-2-PHENYL-4,5-DIHYDROOXAZOL-4-YL)-2-PHENYLETHYL]-DICYCLOHEXYL-PHOSPHINITE)(1,5-COD)IRIDIUM (I) TETRAKIS(3,5-BIS(TRIFLUOROMETHYL)PHENYLBORATE
Formula:
C77H67BF24IrNO2P
Synonyms:
[((4S,5S)-Cy2-Ubaphox)Ir(COD)]BARF;Ubaphox
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 1731.3 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 28 |
| Rotatable Bond Count | 14 |
| Exact Mass | 1731.44832 g/mol |
| Monoisotopic Mass | 1731.44832 g/mol |
| Topological Polar Surface Area | 30.8 Ų |
| Heavy Atom Count | 107 |
| Formal Charge | -1 |
| Complexity | 1850 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 4 |
| Compound Is Canonicalized | Yes |