-
Notifications
You must be signed in to change notification settings - Fork 0
Open
Labels
questionFurther information is requestedFurther information is requested
Description
As of now, the chemical_formula part of the components are just taken from the fortran code. These are, however, not all valid chemical formulas (e.g. mercury has "Hg" (valid), but neohexane has "22-dm-C4" (invalid)). Furthermore, some of the components have three names (e.g. neohexane which has "22-dm-C4" as (invalid!) chemical_formula and the alt_name "2-2-dimethyl-butane(neohexane)"). In the case of neohexane we also see that the chemical_formula and the alt_name are essentially the same, except that the latter is more written out. We should ask PO how they want to have these properties.
Reactions are currently unavailable
Metadata
Metadata
Assignees
Labels
questionFurther information is requestedFurther information is requested