{
  "source": "ORD Dataset Wishlist",
  "snapshot_date": "2026-09-25",
  "ord_wishlist_status_at_snapshot": "Available",
  "ord_wishlist_card": "https://github.com/orgs/open-reaction-database/projects/11?pane=issue&itemId=126570087",
  "ord_data_issue": null,
  "title": "Microtiter Plate (MTP) Reaction Screening and Optimization of Surfactant Chemistry: Examples of Suzuki–Miyaura and Buchwald–Hartwig Cross-Couplings in Water",
  "doi": "10.1021/acs.oprd.8b00200",
  "journal": "OPRD",
  "publication_date": "2018-10-02",
  "authors": [
    "Cara E. Brocklehurst",
    "Fabrice Gallou",
    "J. Constanze D. Hartwieg",
    "Marco Palmieri",
    "Dominik Rufle"
  ],
  "article_open_access": {
    "status": "closed",
    "license": null
  },
  "dataset_size_estimate": null,
  "experiment_type": null,
  "ord_priority": null,
  "ord_difficulty": null,
  "source_data_kind": "plate_images_or_heatmaps",
  "smiles_in_source": "no",
  "needs_author_contact": true,
  "data_locations": [
    {
      "url": "https://doi.org/10.1021/acs.oprd.8b00200",
      "what": "Org. Process Res. Dev. 2018 article and SI with microtiter-plate screens shown as 3D bar plots (ACS site returned a bot challenge)",
      "license": "ACS, closed access"
    }
  ],
  "notes": "Microtiter-plate screening and optimisation of micellar (surfactant-in-water) Suzuki-Miyaura and Buchwald-Hartwig cross-couplings, from Brocklehurst et al., Org. Process Res. Dev. 2018 (doi:10.1021/acs.oprd.8b00200). The screening results are in the Supporting Information but only as 3D bar plots, so numeric yields or conversions cannot be read reliably. Curation needs either the underlying numeric values from the authors or an explicitly documented chart-digitisation approach with stated uncertainty. Surfactant identity and loading (wt% in water), co-solvents and ligands must be encoded as separate inputs. The ORD Dataset must cite the paper DOI.",
  "verification_caveats": "Values digitised from 3D bar plots are approximate and hard to verify; perspective distortion makes bar heights ambiguous. Surfactant or micellar media need careful ORD encoding. The number of reactions is not recorded on the card."
}