AaronTools Chiral Ligand Library

Below are the 47 chiral ligands currently in the AaronTools library. 'Ligand Name' corresponds to the abbreviated name used in AaronTools. When applicable, the source of coordinates is noted. The blue sphere denotes the position of the metal. Hydrogen atoms have been removed for clarity!

Ligand NameFull Ligand NameStructureSource of Coordinates
SS-QuinoxP (S,S)-QuinoxP*
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(from DOI)
RRSS-DuanPhos (1R,1'R,2S,2'S)-DuanPhos
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(from DOI)
SSRR-DuanPhos (1S,1'S,2R,2'R)-DuanPhos
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(from DOI)
R-Ph-BOX 2,2′-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline]
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(from DOI)
S-Ph-BOX 2,2′-Isopropylidenebis[(4S)-4-phenyl-2-oxazoline]
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R-tBu-BOX 2,2′-Isopropylidenebis[(4R)-4-tert-butyl-2-oxazoline]
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S-tBu-BOX 2,2′-Isopropylidenebis[(4S)-4-tert-butyl-2-oxazoline]
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R-iPr-PyBOX 2,6-Bis[4'-(R)-isopropyloxazolin-2'-yl]pyridine
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(from DOI)
S-iPr-PyBOX 2,6-Bis[4'-(S)-isopropyloxazolin-2'-yl]pyridine
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(from DOI)
R-StackPhos (R)-StackPhos
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