{"_buckets": {"deposit": "f33490fb-4a3e-4153-9b0d-91f4b851149f"}, "_deposit": {"created_by": 5, "id": "7392", "owners": [5], "pid": {"revision_id": 0, "type": "depid", "value": "7392"}, "status": "published"}, "_oai": {"id": "oai:gifu-pu.repo.nii.ac.jp:00007392", "sets": ["180"]}, "author_link": ["13081", "20644", "24503", "4538", "26830", "26831", "25094", "26832", "26233", "13080", "26833", "20524"], "item_1_alternative_title_5": {"attribute_name": "論文名よみ", "attribute_value_mlt": [{"subitem_alternative_title": "〓"}]}, "item_1_biblio_info_14": {"attribute_name": "書誌情報", "attribute_value_mlt": [{"bibliographicIssueDates": {"bibliographicIssueDate": "1984-06-15", "bibliographicIssueDateType": "Issued"}, "bibliographicPageEnd": "25", "bibliographicPageStart": "16", "bibliographicVolumeNumber": "33", "bibliographic_titles": [{"bibliographic_title": "岐阜藥科大學紀要"}, {"bibliographic_title": "The annual proceedings of Gifu College of Pharmacy", "bibliographic_titleLang": "en"}]}]}, "item_1_creator_6": {"attribute_name": "著者名(日)", "attribute_type": "creator", "attribute_value_mlt": [{"creatorNames": [{"creatorName": "葛谷, 昌之"}], "nameIdentifiers": [{"nameIdentifier": "13080", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "野口, 章公"}], "nameIdentifiers": [{"nameIdentifier": "25094", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "大野, 弘深"}], "nameIdentifiers": [{"nameIdentifier": "26830", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "奥田, 高千代"}], "nameIdentifiers": [{"nameIdentifier": "20524", "nameIdentifierScheme": "WEKO"}]}]}, "item_1_creator_7": {"attribute_name": "著者名よみ", "attribute_type": "creator", "attribute_value_mlt": [{"creatorNames": [{"creatorName": "クズヤ, マサユキ"}], "nameIdentifiers": [{"nameIdentifier": "13081", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "ノグチ, アキヒロ"}], "nameIdentifiers": [{"nameIdentifier": "26831", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "オオノ, ヒロミ"}], "nameIdentifiers": [{"nameIdentifier": "26832", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "オクダ, タカチヨ"}], "nameIdentifiers": [{"nameIdentifier": "20644", "nameIdentifierScheme": "WEKO"}]}]}, "item_1_creator_8": {"attribute_name": "著者名(英)", "attribute_type": "creator", "attribute_value_mlt": [{"creatorNames": [{"creatorName": "KUZUYA, MASAYUKI", "creatorNameLang": "en"}], "nameIdentifiers": [{"nameIdentifier": "4538", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "NOGUCHI, AKIHIRO", "creatorNameLang": "en"}], "nameIdentifiers": [{"nameIdentifier": "24503", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "OHNO, HIROMI", "creatorNameLang": "en"}], "nameIdentifiers": [{"nameIdentifier": "26833", "nameIdentifierScheme": "WEKO"}]}, {"creatorNames": [{"creatorName": "OKUDA, TAKACHIYO", "creatorNameLang": "en"}], "nameIdentifiers": [{"nameIdentifier": "26233", "nameIdentifierScheme": "WEKO"}]}]}, "item_1_description_1": {"attribute_name": "ページ属性", "attribute_value_mlt": [{"subitem_description": "P(論文)", "subitem_description_type": "Other"}]}, "item_1_description_11": {"attribute_name": "抄録(日)", "attribute_value_mlt": [{"subitem_description": "2-Pyridone互変異性平衡の分子軌道法による研究の変遷を紹介する。溶液中でpyridone formが圧倒的濃度を占めるという実験結果を基に, 確実視されていたpyridone formのより大きな安定性は, 当時主流的な計算法であったπ一電子分子軌道論によって再現され, 理論的にも支持が得られていた。しかし, 1973年のP.Beakによる\u0027\u00272-pyridone formと2-pyridinolformとの間には, 本質的なエネルギ」差がない\"という実測値の論文報告を契機に, 両互変異性体間のエネルギー差の縮小に向って, 再び分子軌道法による研究が再燃し, 全原子価電子を扱う半経験的分子軌道法による計算結果が多数報告された。そして1980年代に入りようやく, 高度な非経験的分子軌道法(ab initio 法)によってその実測値が再現きれるようになった。さらに, pyridone互変異性平衡に与える置換基効果の分子軌道法による研究の一端にも言及する。", "subitem_description_type": "Other"}]}, "item_1_description_12": {"attribute_name": "抄録(英)", "attribute_value_mlt": [{"subitem_description": "The molecular orbital (MO) studies on tautomeric 2-pyridone have been reviewed : The greater stability of the pyridone form which was widely believed based on the experimental fact that the tautomeric equilibrium lies far to the pyridone form in solution had theoretically been reproduced by π-SCF MO calculations. However, in 1973,P. Beak has reported the experimental observation that there is no significant difference in fundamental stabilities of the tautomers in the gas phase. Since then, the efforts have been made for minimizing the difference in such stabilities by semiempirical MO calculations. And, it is not until the early 1980\u0027s that the precise energy difference has been reproduced by sophisticated ab initio calculations. Further, the MO studies of the substituent effect on the tautomeric equilibrium have also been introduced.", "subitem_description_type": "Other"}]}, "item_1_source_id_13": {"attribute_name": "雑誌書誌ID", "attribute_value_mlt": [{"subitem_source_identifier": "AN00053514", "subitem_source_identifier_type": "NCID"}]}, "item_1_text_10": {"attribute_name": "著者所属(英)", "attribute_value_mlt": [{"subitem_text_language": "en", "subitem_text_value": "Department of Pharmaceutical Physical Chemistry, Gifu Pharmaceutical University/Department of Pharmaceutical Physical Chemistry, Gifu Pharmaceutical University/Department of Pharmaceutical Physical Chemistry, Gifu Pharmaceutical University/Department of Pharmaceutical Physical Chemistry, Gifu Pharmaceutical University"}]}, "item_1_text_9": {"attribute_name": "著者所属(日)", "attribute_value_mlt": [{"subitem_text_value": "岐阜薬科大学/岐阜薬科大学/岐阜薬科大学/岐阜薬科大学"}]}, "item_files": {"attribute_name": "ファイル情報", "attribute_type": "file", "attribute_value_mlt": [{"accessrole": "open_date", "date": [{"dateType": "Available", "dateValue": "1984-06-15"}], "displaytype": "detail", "download_preview_message": "", "file_order": 0, "filename": "KJ00000071634.pdf", "filesize": [{"value": "755.1 kB"}], "format": "application/pdf", "future_date_message": "", "is_thumbnail": false, "licensetype": "license_free", "mimetype": "application/pdf", "size": 755100.0, "url": {"url": "https://gifu-pu.repo.nii.ac.jp/record/7392/files/KJ00000071634.pdf"}, "version_id": "e692176b-826d-4ed1-ac8c-4fca5ca309bb"}]}, "item_language": {"attribute_name": "言語", "attribute_value_mlt": [{"subitem_language": "jpn"}]}, "item_resource_type": {"attribute_name": "資源タイプ", "attribute_value_mlt": [{"resourcetype": "departmental bulletin paper", "resourceuri": "http://purl.org/coar/resource_type/c_6501"}]}, "item_title": "\u003c総説\u003e2-Pyridoneの互変異性の分子軌道法による研究の変遷", "item_titles": {"attribute_name": "タイトル", "attribute_value_mlt": [{"subitem_title": "\u003c総説\u003e2-Pyridoneの互変異性の分子軌道法による研究の変遷"}, {"subitem_title": "Advances in Molecular Orbital Studies on Tautomeric 2-Pyridones", "subitem_title_language": "en"}]}, "item_type_id": "1", "owner": "5", "path": ["180"], "permalink_uri": "https://gifu-pu.repo.nii.ac.jp/records/7392", "pubdate": {"attribute_name": "公開日", "attribute_value": "1984-06-15"}, "publish_date": "1984-06-15", "publish_status": "0", "recid": "7392", "relation": {}, "relation_version_is_last": true, "title": ["\u003c総説\u003e2-Pyridoneの互変異性の分子軌道法による研究の変遷"], "weko_shared_id": 5}