{
  "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=126980452",
  "ord_data_issue": null,
  "title": "Substrate-Photocatalyst Reactivity Matching Enables Broad Aryl Halide Scope in Light-Driven, Reductive Cross-Electrophile Coupling Using 13C NMR as a Predictor",
  "doi": "10.1021/acscatal.5c02019",
  "journal": "ACS Catalysis",
  "publication_date": "2025-05-01",
  "authors": [
    "Cameron H. Chrisman",
    "W. Zachary Elder",
    "Graham C. Haug",
    "Raúl Pérez‐Soto",
    "Amreen K. Bains",
    "Claire Jepsen",
    "Trevor K. Stewart",
    "Trevor C. Sherwood",
    "Max Kudisch",
    "David J. Boston",
    "Chern‐Hooi Lim",
    "Eric M. Simmons"
  ],
  "article_open_access": {
    "status": "closed",
    "license": null
  },
  "dataset_size_estimate": 500,
  "experiment_type": "HTE",
  "ord_priority": "High",
  "ord_difficulty": "Hard",
  "source_data_kind": "si_pdf_tables",
  "smiles_in_source": "no",
  "needs_author_contact": false,
  "data_locations": [
    {
      "url": "https://doi.org/10.1021/acscatal.5c02019",
      "what": "Article (ACS Catalysis 2025). Crossref lists only ACS policy licenses, and OpenAlex marks it closed.",
      "license": "closed (ACS standard terms)"
    },
    {
      "url": "https://pubs.acs.org/doi/suppl/10.1021/acscatal.5c02019",
      "what": "SI PDF with plate maps and tables (per ORD curator notes)",
      "license": "unknown (ACS SI)"
    }
  ],
  "notes": "Paper: https://doi.org/10.1021/acscatal.5c02019 (ACS Catalysis 2025), an HTE study of light-driven reductive cross-electrophile coupling of aryl halides, pairing substrates with photocatalysts. According to the ORD curator notes, the Supporting Information PDF contains the data as plate maps plus tables, about 500 reactions. The compounds are given as structure drawings, so every substrate, photocatalyst and product must be converted to SMILES. The article is not open access; get the SI from the publisher page. Check whether the plate-map values are real text or embedded images before committing to the work.",
  "verification_caveats": "Plate maps may be color-coded images with embedded values. Structure-to-SMILES conversion by hand or OCSR is error-prone. There are probably several screens: a substrate-photocatalyst matrix and a scope. Yield type (assay or isolated) is unknown."
}