Wolfram Language Paclet Repository
Community-contributed installable additions to the Wolfram Language
WolframChemistry`ChemistryFunctions`
AtomChirality  |
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Details and Options
Examples
(3)
Basic Examples
(3)
Find the chirality for a specific atom:
In[1]:=
 | AtomChirality |
Out[1]=
S
Look at the same molecule with no stereo specified:
In[2]:=
| AtomChirality |
Out[2]=
Unspecified
Find the chirality for a list of atoms:
In[1]:=
| AtomChirality |
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Out[1]=
{R,R,None}
Find all chiral centers in a molecule:
In[1]:=
| AtomChirality |
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Out[1]=
3S,9R,10R,13R,14R,18R,19R,23R,27S,30R,32R,35S,36S,37R
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""