Technical Documentation => Chemical Structures => Specialities

Specialities


Validation - Stereochemistry - Racemates - More Stereo Centers - Stereobond, Down Bonds - Metal Complexes - Nitro Groups - Polymers
Hydrochlorids of Amines - Aromatic Systems - Ferrocenes and Metallocenes - Mesomers, pi-systems - Tautomers - Specialities

Description

These examples explain

 

A Chiral sulfoxids: define the stereo chemistry by the single bonds.
B Metal carbonyl complex
C Metal bonded to a p-orbital. Treat h complexes in a similar manner.
D Chiral allens: SciDex do not calculate the chirality of allens. If you want to register enantiomeric allens, you have to do:- use up and down bonds (only for your display, they are not analysed by SciDex )- give a UQ attribute to the molecule, e.g. "UQ +" or "UQ R"- set "ST chiral" to the molecule

 

E Axial chirality of biphenyls have to be defined by UQ and ST attributes, similar then in D.


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