{"_buckets": {"deposit": "3d8e2303-65c6-4f1d-952b-c1e0fddeeaf8"}, "_deposit": {"created_by": 17, "id": "2002159", "owner": "17", "owners": [17], "owners_ext": {"displayname": "\u56f3\u66f8\u60c5\u5831\u4fc2", "username": "repository"}, "pid": {"revision_id": 0, "type": "depid", "value": "2002159"}, "status": "published"}, "_oai": {"id": "oai:nagoya.repo.nii.ac.jp:02002159", "sets": []}, "author_link": [], "control_number": "2002159", "item_1615768549627": {"attribute_name": "\u51fa\u7248\u30bf\u30a4\u30d7", "attribute_value_mlt": [{"subitem_version_resource": "http://purl.org/coar/version/c_ab4af688f83e57aa", "subitem_version_type": "AM"}]}, "item_1629683748249": {"attribute_name": "\u65e5\u4ed8", "attribute_value_mlt": [{"subitem_date_issued_datetime": "2022-12-07", "subitem_date_issued_type": "Available"}]}, "item_9_biblio_info_6": {"attribute_name": "\u66f8\u8a8c\u60c5\u5831", "attribute_value_mlt": [{"bibliographicIssueDates": {"bibliographicIssueDate": "2021-12-07", "bibliographicIssueDateType": "Issued"}, "bibliographicIssueNumber": "23", "bibliographicPageEnd": "4924", "bibliographicPageStart": "4912", "bibliographicVolumeNumber": "13", "bibliographic_titles": [{"bibliographic_title": "ChemCatChem", "bibliographic_titleLang": "en"}]}]}, "item_9_description_4": {"attribute_name": "\u5185\u5bb9\u8a18\u8ff0", "attribute_value_mlt": [{"subitem_description": "The reaction of a tungsten carbyne complex, MeC\u2261WBr(CO)4, with 1,6-heptadiyne was investigated using density functional theory (DFT) calculations. It was suggested that the plausible mechanism involves [2+2] cycloaddition of the carbyne with the diyne, subsequent insertion of CO and alkyne into a metallacyclobutadiene intermediate, and a final reductive elimination step from a metallacycloheptatrienone intermediate to produce a \u03b7^5-cyclohexadienyl complex. A related Ru-catalyzed reaction of 1,6-heptadiyne involving a hydroxycarbyne complex was investigated to propose a possible pathway starting from a bis(hydroxycarbyne) complex, (HOC\u2261)2Ru(CO)2. It was found that the biscarbyne complex undergoes carbyne-carbyne coupling to generate a stable metallacyclopropene intermediate, which reacts with 1,6-heptadiyne through two different pathways to produce the final \u03b7^6-arene complex. Moreover, a non-carbyne pathway was also investigated to propose an alternative mechanism.", "subitem_description_language": "en", "subitem_description_type": "Abstract"}]}, "item_9_publisher_32": {"attribute_name": "\u51fa\u7248\u8005", "attribute_value_mlt": [{"subitem_publisher": "Wiley", "subitem_publisher_language": "en"}]}, "item_9_relation_43": {"attribute_name": "\u95a2\u9023\u60c5\u5831", "attribute_value_mlt": [{"subitem_relation_type": "isVersionOf", "subitem_relation_type_id": {"subitem_relation_type_id_text": "https://doi.org/10.1002/cctc.202101218", "subitem_relation_type_select": "DOI"}}]}, "item_9_rights_12": {"attribute_name": "\u6a29\u5229", "attribute_value_mlt": [{"subitem_rights": "\"This is the peer reviewed version of the following article: [Y. Yamamoto, ChemCatChem 2021, 13, 4912.], which has been published in final form at [https://doi.org/10.1002/anie.202014946]. This article may be used for non-commercial purposes in accordance with Wiley Terms and Conditions for Use of Self-Archived Versions. This article may not be enhanced, enriched or otherwise transformed into a derivative work, without express permission from Wiley or by statutory rights under applicable legislation. Copyright notices must not be removed, obscured or modified. The article must be linked to Wiley\u2019s version of record on Wiley Online Library and any embedding, framing or otherwise making available the article or pages thereof by third parties from platforms, services and websites other than Wiley Online Library must be prohibited.\"", "subitem_rights_language": "en"}]}, "item_9_source_id_7": {"attribute_name": "\u53ce\u9332\u7269\u8b58\u5225\u5b50", "attribute_value_mlt": [{"subitem_source_identifier": "1867-3880", "subitem_source_identifier_type": "PISSN"}]}, "item_access_right": {"attribute_name": "\u30a2\u30af\u30bb\u30b9\u6a29", "attribute_value_mlt": [{"subitem_access_right": "embargoed access", "subitem_access_right_uri": "http://purl.org/coar/access_right/c_f1cf"}]}, "item_creator": {"attribute_name": "\u8457\u8005", "attribute_type": "creator", "attribute_value_mlt": [{"creatorNames": [{"creatorName": "Yamamoto, Yoshihiko", "creatorNameLang": "en"}]}]}, "item_files": {"attribute_name": "\u30d5\u30a1\u30a4\u30eb\u60c5\u5831", "attribute_type": "file", "attribute_value_mlt": [{"accessrole": "open_date", "date": [{"dateType": "Available", "dateValue": "2022-12-07"}], "displaytype": "detail", "download_preview_message": "Download / Preview is available from 2022/12/6.", "file_order": 0, "filename": "manuscript.pdf", "filesize": [{"value": "4.6 MB"}], "format": "application/pdf", "future_date_message": "Download is available from 2022/12/6.", "is_thumbnail": false, "mimetype": "application/pdf", "size": 4600000.0, "url": {"objectType": "fulltext", "url": "https://nagoya.repo.nii.ac.jp/record/2002159/files/manuscript.pdf"}, "version_id": "1d32ef0f-cb2c-4b8d-ab4a-0d1e09067dd0"}]}, "item_language": {"attribute_name": "\u8a00\u8a9e", "attribute_value_mlt": [{"subitem_language": "eng"}]}, "item_resource_type": {"attribute_name": "\u8cc7\u6e90\u30bf\u30a4\u30d7", "attribute_value_mlt": [{"resourcetype": "journal article", "resourceuri": "http://purl.org/coar/resource_type/c_6501"}]}, "item_title": "Computational Mechanistic Study of Fused Phenol Formations from 1,6\u2010Heptadiyne Involving Carbyne Complexes", "item_titles": {"attribute_name": "\u30bf\u30a4\u30c8\u30eb", "attribute_value_mlt": [{"subitem_title": "Computational Mechanistic Study of Fused Phenol Formations from 1,6\u2010Heptadiyne Involving Carbyne Complexes", "subitem_title_language": "en"}]}, "item_type_id": "40001", "owner": "17", "path": ["1903/1904/1905"], "permalink_uri": "http://hdl.handle.net/2237/0002002159", "pubdate": {"attribute_name": "PubDate", "attribute_value": "2022-03-08"}, "publish_date": "2022-03-08", "publish_status": "0", "recid": "2002159", "relation": {}, "relation_version_is_last": true, "title": ["Computational Mechanistic Study of Fused Phenol Formations from 1,6\u2010Heptadiyne Involving Carbyne Complexes"], "weko_shared_id": -1}