Slot: reactant

Reactant(s) used in the reaction. Provide compound name, CAS number,

or SMILES. For feeds, include composition and flow rate where known.

Applicable Classes

Name	Description	Modifies Slot
Reaction	An EvaluatedActivity representing the catalytic reaction being studied. Reaction is NOT a DataGeneratingActivity — it is the catalytic process being observed, not the process that generates the dataset. A CatalysisDataset is linked to the Reaction it is about via is_about_activity. For operando experiments (e.g. in-situ XRD during a reaction), the dataset carries both: was_generated_by: Characterization (the measurement producing data) is_about_activity: Reaction (the catalytic process being monitored) The reactor is linked via carried_out_by as a ReactorDesignType (Device). Reactants are linked via had_input_entity. The type of catalytic reaction (e.g. ammonia synthesis, CO oxidation) is expressed via rdf_type using a voc4cat or ChemO term.	no

Properties

Range: String
Multivalued: True
Required: True

Identifier and Mapping Information

Schema Source

from schema: https://w3id.org/nfdi4cat/coremeta4cat

Mappings

Mapping Type	Mapped Value
self	VOC4CAT:0000101
native	coremeta4cat:reactant

LinkML Source

name: reactant
description: 'Reactant(s) used in the reaction. Provide compound name, CAS number,

  or SMILES. For feeds, include composition and flow rate where known.'
from_schema: https://w3id.org/nfdi4cat/coremeta4cat
rank: 1000
slot_uri: VOC4CAT:0000101
alias: reactant
domain_of:
- Reaction
range: string
required: true
multivalued: true