\u94c1\u50ac\u5316\u7684\u7aef\u7094\u4e59\u70ef\u57fa\u950c<\/strong><\/a>\u5316\u53cd\u5e94<\/p>\n\u6709\u673a\u950c\u8bd5\u5242\u662f\u73b0\u4ee3\u5408\u6210\u5316\u5b66\u6700\u5e38\u7528\u7684\u91d1\u5c5e\u8bd5\u5242\u4e4b\u4e00\u3002\u7094\u70c3\u7684\u78b3\u950c\u5316\u53cd\u5e94\u662f\u5408\u6210\u6709\u673a\u950c\u8bd5\u5242\u7684\u91cd\u8981\u65b9\u6cd5\uff0c\u4f46\u662f\u76ee\u524d\u666e\u904d\u5b58\u5728\u65e0\u6cd5\u8010\u53d7\u7aef\u7094\u7684\u6c22\u548c\u5f15\u5165\u7684\u78b3\u57fa\u56e2\u96be\u4ee5\u8f6c\u5316\u7b49\u95ee\u9898\uff0c\u4e25\u91cd\u9650\u5236\u4e86\u8be5\u53cd\u5e94\u7684\u5e94\u7528\u3002\u7094\u70c3\u7684\u50ac\u5316\u4e59\u70ef\u57fa\u950c\u5316\uff0c\u53ef\u4ee5\u5728\u7094\u70c3\u4e24\u7aef\u540c\u65f6\u5f15\u5165\u6613\u4e8e\u8f6c\u5316\u7684\u70ef\u57fa\u548c\u950c\uff0c\u5728\u5408\u6210\u4e2d\u6709\u91cd\u8981\u7684\u5e94\u7528\u6f5c\u529b\u3002\u7136\u800c\uff0c\u8981\u5b9e\u73b0\u7aef\u7094\u7684\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94\u9700\u8981\u514b\u670d\u591a\u79cd\u6311\u6218\uff1a\uff081\uff09\u7aef\u7094\u7684\u9178\u6027\u6c22\u80fd\u591f\u6dec\u706d\u50ac\u5316\u5242\uff0c\u6216\u8005\u548c\u950c\u8bd5\u5242\u53d1\u751f\u7f6e\u6362\u53cd\u5e94\uff1b\uff082\uff09\u7aef\u7094\u5bb9\u6613\u5728\u8fc7\u6e21\u91d1\u5c5e\u50ac\u5316\u5242\u4f5c\u7528\u4e0b\u53d1\u751f\u4e8c\u805a\uff0c\u751f\u6210\u70ef\u7094\u5316\u5408\u7269\uff1b\uff083\uff09\u70ef\u57fa\u950c\u4ea7\u7269\u53ef\u80fd\u8fdb\u4e00\u6b65\u548c\u7094\u70c3\u53d1\u751f\u70ef\u57fa\u950c\u5316\uff0c\u751f\u6210\u7094\u70c3\u9f50\u805a\u4ea7\u7269\uff1b\uff084\uff09\u950c\u8bd5\u5242\u5728\u8fc7\u6e21\u91d1\u5c5e\u7684\u50ac\u5316\u4e0b\u53ef\u80fd\u751f\u6210\u81ea\u7531\u57fa\uff0c\u5bfc\u81f4\u53cd\u5e94\u7684\u7acb\u4f53\u9009\u62e9\u6027\u96be\u4ee5\u63a7\u5236\u3002<\/p>\n
\u6700\u8fd1\uff0c\u5357\u5f00\u5927\u5b66\u5316\u5b66\u5b66\u9662\u6731\u5b88\u975e\u8bfe\u9898\u7ec4\u53d1\u5c55\u4e86\u4e00\u79cd1,10-\u83f2\u7f57\u5549-\u4e9a\u80fa\u914d\u4f53\u4fee\u9970\u7684\u94c1\u50ac\u5316\u5242\uff0c\u9996\u6b21\u5b9e\u73b0\u4e86\u6781\u5177\u6311\u6218\u7684\u7aef\u7094\u7684\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94\uff0c\u4e3a\u6709\u673a\u950c\u8bd5\u5242\u548c\u591a\u53d6\u4ee3\u5171\u8f6d\u70ef\u70c3\u7684\u5408\u6210\u63d0\u4f9b\u4e86\u65b0\u7684\u9ad8\u6548\u7684\u65b9\u6cd5\u3002\u8be5\u53cd\u5e94\u5177\u6709\u975e\u5e38\u597d\u7684\u5b98\u80fd\u56e2\u8010\u53d7\u6027\u548c\u5e95\u7269\u666e\u9002\u6027\uff0c\u88ab\u6210\u529f\u7528\u4e8e\u7ef4\u751f\u7d20A\u7b49\u91cd\u8981\u751f\u7269\u6d3b\u6027\u5206\u5b50\u7684\u7b80\u6377\u5408\u6210\uff0c\u663e\u8457\u63d0\u9ad8\u4e86\u5408\u6210\u6548\u7387\u3002\u7814\u7a76\u6210\u679c\u8fd1\u671f\u4e3a\u9898\u53d1\u8868\u5728J. Am. Chem. Soc.\uff0c\u5e76\u88ab\u7f16\u8f91\u9009\u4e3aJACS Spotlights\u3002\u535a\u58eb\u751f\u9ec4\u5f3a\u4e3a\u672c\u6587\u7b2c\u4e00\u4f5c\u8005\u3002<\/p>\n
\u50ac\u5316\u7aef\u7094\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94<\/p>\n
\u7814\u7a76\u53d1\u73b0\uff0c\u90bb\u83f2\u7f57\u5549-\u4e9a\u80fa\u7684\u94c1\u914d\u5408\u7269\u5728\u6a21\u578b\u53cd\u5e94\u4e2d\u8868\u73b0\u51fa\u5f88\u9ad8\u7684\u50ac\u5316\u6d3b\u6027\uff0c\u7279\u522b\u662f\u90bb\u83f2\u7f57\u5549\u9aa8\u67b69\u4f4d\u5e26\u6709\u5927\u4f4d\u963b2,4,6-\u4e09\u5f02\u4e19\u57fa\u57fa\u7684\u50ac\u5316\u5242C1-C3\u548c2,4,6-\u4e09\u7532\u57fa\u7684\u50ac\u5316\u5242C6\u53ef\u4ee5\u4ee5\u8fd1\u4e4e\u5b9a\u91cf\u7684\u6536\u7387\u548c\u5355\u4e00\u7684\u533a\u57df\u9009\u62e9\u6027\u548c\u7acb\u4f53\u9009\u62e9\u6027\u5f97\u5230\u4e59\u70ef\u57fa\u950c\u5316\u4ea7\u72692\u3002\u5176\u4ed6\u4e09\u9f7f\u914d\u4f53\u3001\u53cc\u9f7f\u6c2e\u914d\u4f53\u3001\u5355\u81a6\u914d\u4f53\u548c\u53cc\u81a6\u914d\u4f53\u5747\u4e0d\u80fd\u7ed9\u51fa\u597d\u7684\u7ed3\u679c\u3002\u5c06C3\u50ac\u5316\u5242\u4e2d\u7684\u4e2d\u5fc3\u91d1\u5c5e\u94c1\u6362\u4e3a\u5176\u5b83\u91d1\u5c5e\uff0c\u53cd\u5e94\u7684\u6d3b\u6027\u548c\u9009\u62e9\u6027\u90fd\u660e\u663e\u964d\u4f4e\u3002<\/p>\n
\u53cd\u5e94\u4f18\u5316<\/p>\n
<\/p>\n
\u5728\u6700\u4f18\u6761\u4ef6\u4e0b\uff0c\u7814\u7a76\u8005\u8003\u5bdf\u4e86\u5e95\u7269\u8303\u56f4\u3002\u8be5\u53cd\u5e94\u6709\u5f88\u597d\u7684\u5b98\u80fd\u56e2\u8010\u53d7\u6027\uff0c\u7532\u6c27\u57fa\u3001\u80fa\u57fa\u3001\u7845\u57fa\u3001\u5def\u57fa\u3001\u916f\u57fa\u3001\u9170\u57fa\u3001\u9170\u80fa\u57fa\u3001\u6c30\u57fa\u3001\u781c\u57fa\u3001\u7f29\u919b\u57fa\u3001\u4e09\u6c1f\u7532\u57fa\u3001\u5364\u7d20\u90fd\u80fd\u8010\u53d7\u3002\u5e26\u6709\u6d3b\u6cfc\u8d28\u5b50\u7684\u5b98\u80fd\u56e2\uff08-NHMe, -OH\uff09\u7684\u7094\u70c3\u5e95\u7269\u540c\u6837\u53ef\u4ee5\u987a\u5229\u53d1\u751f\u53cd\u5e94\u3002\u7a20\u73af\u53d6\u4ee3\u7684\u4e59\u7094\uff082-\u8418\u4e59\u7094\uff09\u548c\u82b3\u6742\u73af\u53d6\u4ee3\u7684\u4e59\u7094\uff08\u544b\u5583\u3001\u567b\u5429\u3001\u5421\u5576\u3001\u5432\u54da\u53d6\u4ee3\u7684\u4e59\u7094\uff09\u540c\u6837\u80fd\u7ed9\u51fa\u8f83\u597d\u7684\u7ed3\u679c\u3002\u9664\u4e86\u4e59\u70ef\u57fa\u950c\uff0c\u5176\u4ed6\u70ef\u57fa\u950c\u4e5f\u53ef\u7528\u4e8e\u8be5\u53cd\u5e94\uff0c\u03b2-\u70f7\u57fa\u3001\u03b1-\u70f7\u57fa\u3001\u53cc\u70f7\u57fa\u3001\u82b3\u57fa\u53d6\u4ee3\u4e59\u70ef\u57fa\u950c\u8bd5\u5242\u53cd\u5e94\u6d3b\u6027\u4f9d\u6b21\u964d\u4f4e\u3002<\/p>\n
\u94c1\u50ac\u5316\u82b3\u57fa\u7aef\u7094\u7684\u70ef\u57fa\u950c\u5316\u53cd\u5e94<\/p>\n
<\/p>\n
\u9664\u4e86\u82b3\u57fa\u53d6\u4ee3\u7aef\u7094\uff0c\u5171\u8f6d\u70ef\u7094\uff0c\u8102\u80aa\u57fa\u7aef\u7094\uff0c\u5b98\u80fd\u56e2\u5316\u7094\u70c3\u4e5f\u80fd\u591f\u5728\u94c1\u50ac\u5316\u5242\u4fc3\u8fdb\u4e0b\u987a\u5229\u53d1\u751f\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94\uff0c\u4ee5\u8f83\u9ad8\u7684\u6536\u7387\u548c\u5f88\u9ad8\u7684\u533a\u57df\u548c\u7acb\u4f53\u9009\u62e9\u6027\u7ed9\u51fa\u76f8\u5e94\u7684\u4ea7\u7269\u3002<\/p>\n
\u94c1\u50ac\u5316\u5176\u5b83\u7aef\u7094\u7684\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94<\/p>\n
<\/p>\n
\u8be5\u53cd\u5e94\u8868\u73b0\u51fa\u826f\u597d\u7684\u5b98\u80fd\u56e2\u8010\u53d7\u6027\uff0c\u53ef\u7528\u4e8e\u591a\u529f\u80fd\u5316\u836f\u7269\u5206\u5b50\u7684\u540e\u671f\u4fee\u9970\u4e2d\u3002\u5229\u4f10\u6c99\u73ed\u3001\u51b3\u5948\u8fbe\u9686\u3001\u975e\u5e03\u7d22\u5766\u3001\u5ea6\u6d1b\u897f\u6c40\u3001\u96cc\u915a\u916e\u548c\u9b3c\u81fc\u6bd2\u7d20\u884d\u751f\u7269\u80fd\u591f\u4ee5\u826f\u597d\u81f3\u8f83\u9ad8\u7684\u4ea7\u7387\u548c\u4f18\u5f02\u7684\u9009\u62e9\u6027\u5f97\u5230\u76f8\u5e94\u7684\u4e59\u70ef\u57fa\u950c\u5316\u4ea7\u72692ga-2gf\u3002<\/p>\n
\u836f\u7269\u5206\u5b50\u7684\u540e\u671f\u4fee\u9970<\/p>\n
\u8be5\u65b9\u6cd5\u5728\u5408\u6210\u4e2d\u6709\u5f88\u597d\u7684\u5e94\u7528\u6f5c\u529b\u3002\u4ea7\u7269\u4e2d\u7684C-Zn\u952e\u53ef\u53d1\u751f\u4e00\u7cfb\u5217\u8f6c\u5316\uff0c\u5305\u62ec\u70f7\u57fa\u5316\u3001\u82b3\u57fa\u5316\u3001\u70ef\u4e19\u57fa\u5316\u3001\u7094\u57fa\u5316\u548c\u52a0\u6210\u53cd\u5e94\uff0c\u9ad8\u6548\u751f\u6210\u591a\u79cd\u591a\u53d6\u4ee3\u5171\u8f6d\u70ef\u70c3\u3002\u8be5\u53cd\u5e94\u8fd8\u88ab\u6210\u529f\u5e94\u7528\u4e8e\u591a\u79cd\u751f\u7269\u6d3b\u6027\u5206\u5b50\uff0c\u5305\u62ec\u7ef4\u751f\u7d20A\u53ca\u5176\u884d\u751f\u7269\u7684\u9ad8\u6548\u3001\u9ad8\u9009\u62e9\u6027\u5408\u6210\uff0c\u548c\u6587\u732e\u65b9\u6cd5\u76f8\u6bd4\uff0c\u663e\u8457\u63d0\u5347\u4e86\u5408\u6210\u6548\u7387\u3002<\/p>\n
\u94c1\u50ac\u5316\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94\u7684\u5e94\u7528<\/p>\n
\u7814\u7a76\u8005\u5bf9\u673a\u7406\u8fdb\u884c\u4e86\u7cfb\u7edf\u7814\u7a76\uff1a\u8868\u5f81\u4e86\u6709\u673a\u950c\u4ea7\u7269\u7684\u7ed3\u6784\uff1b\u53d1\u73b0\u7aef\u7094\u7684\u6c22\u5f88\u5bb9\u6613\u548c\u950c\u8bd5\u5242\u53d1\u751f\u4ea4\u6362\u53cd\u5e94\uff0c\u800c\u94c1\u50ac\u5316\u5242\u53ef\u6291\u5236\u6b64\u80cc\u666f\u53cd\u5e94\uff1b\u6c18\u5e26\u6807\u8bb0\u5b9e\u9a8c\u663e\u793a\u5e95\u7269\u548c\u4ea7\u7269\u5747\u6ca1\u6709H-D\u4ea4\u6362\u4e59\u70ef\u57fa\u950c\u53ef\u5c06Fe(II)\u524d\u4f53\u8fd8\u539f\u4e3aFe(I)\u6d3b\u6027\u50ac\u5316\u5242\u3002DFT\u8ba1\u7b97\u7ed3\u679c\u663e\u793a\uff0c\u6d3b\u6027\u94c1\u7269\u79cd\u4ee5\u5f00\u58f3\u5c42\u56db\u91cd\u6001\uff08S = 3\/2\uff09\u65b9\u5f0f\u50ac\u5316\u53cd\u5e94\uff1b\u03b2-\u52a0\u6210\u6d3b\u5316\u80fd\uff0810.9 kcal\/mol\uff09\u6bd4\u03b1-\u52a0\u6210\u6d3b\u5316\u80fd\uff080.9 kcal\/mol\uff09\u9ad8\u4e8610.0 kcal\/mol\uff0c\u4e8c\u6b21\u63d2\u5165\u7684\u6d3b\u5316\u80fd\uff0810.6 kcal\/mol\uff09\u4e5f\u8fdc\u9ad8\u4e8e\u4e00\u6b21\u63d2\u5165\u6d3b\u5316\u80fd\uff080.9 kcal\/mol\uff09\uff1b\u5bf9\u8fc7\u6e21\u6001\u7ed3\u6784\u548c\u524d\u7ebf\u8f68\u9053\u5206\u6790\u53d1\u73b0\uff0cTS1\u4e2dFe\u7684dz2\u8f68\u9053\u4e0e\u90bb\u83f2\u7f57\u5549\u7684\u03c0\u8f68\u9053\u5177\u6709p-\u03c0\u5171\u8f6d\u4f5c\u7528\uff0c\u4f7f\u5f97\u7535\u8377\u66f4\u52a0\u5206\u6563\uff0c\u56e0\u6b64\u80fd\u91cf\u66f4\u4f4e\u3002\u603b\u4f53\u800c\u8a00\uff0c\u914d\u4f53\u6784\u7b51\u7684\u62e5\u6324\u53cd\u5e94\u7a7a\u8154\u548c\u94c1\u539f\u5b50\u8f83\u5c0f\u7684\u539f\u5b50\u534a\u5f84\uff0c\u4f7f\u5f97\u94c1\u50ac\u5316\u5242\u80fd\u591f\u7cbe\u51c6\u7684\u8bc6\u522b\u7094\u70c3\u4e24\u7aef\u53d6\u4ee3\u57fa\u7684\u5dee\u5f02\uff0c\u7ed9\u51fa\u9ad8\u7684\u533a\u57df\u9009\u62e9\u6027\uff1b\u800c\u94c1\u50ac\u5316\u5242\u5f00\u58f3\u5c42\u7ed3\u6784\uff0c\u663e\u8457\u964d\u4f4e\u4e86\u53cd\u5e94\u7684\u8fc7\u6e21\u6001\u80fd\u5792\uff0c\u51cf\u5c11\u4e86\u7aef\u7094\u9178\u6027\u6c22\u548c\u950c\u8bd5\u5242\u7684\u7f6e\u6362\u3001\u7094\u70c3\u4e8c\u805a\u3001\u70ef\u57fa\u950c\u4ea7\u7269\u8fdb\u4e00\u6b65\u9f50\u805a\u7b49\u7ade\u4e89\u53cd\u5e94\uff0c\u56e0\u800c\u5b9e\u73b0\u4e86\u9ad8\u7684\u5316\u5b66\u9009\u62e9\u6027\u3002<\/p>\n
\u673a\u7406\u7814\u7a76<\/p>\n
\u603b\u4e4b\uff0c\u6731\u5b88\u975e\u8bfe\u9898\u7ec4\u53d1\u5c55\u4e86\u4e00\u79cd\u57fa\u4e8e1,10-\u83f2\u7f57\u5549-\u4e9a\u80fa\u9aa8\u67b6\u7684\u4e09\u9f7f\u6c2e\u914d\u4f53\u548c\u94c1\u7684\u914d\u5408\u7269\u50ac\u5316\u5242\uff0c\u9996\u6b21\u5b9e\u73b0\u4e86\u7aef\u7094\u7684\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94\u3002\u8be5\u53cd\u5e94\u5177\u6709\u5f88\u597d\u7684\u5b98\u80fd\u56e2\u8010\u53d7\u6027\u548c\u5e95\u7269\u666e\u9002\u6027\uff0c\u540c\u65f6\u8fd8\u5177\u6709\u5f88\u597d\u7684\u5316\u5b66\u9009\u62e9\u6027\u3001\u533a\u57df\u9009\u62e9\u6027\u548c\u7acb\u4f53\u9009\u62e9\u6027\u3002\u5171\u8f6d\u70ef\u57fa\u950c\u4ea7\u7269\u53ef\u4ee5\u8fdb\u884c\u591a\u79cd\u8f6c\u5316\uff0c\u88ab\u6210\u529f\u7528\u4e8e\u591a\u79cd\u5929\u7136\u4ea7\u7269\u53ca\u836f\u7269\u4e2d\u95f4\u4f53\u7684\u5408\u6210\uff0c\u663e\u8457\u63d0\u5347\u4e86\u5408\u6210\u6548\u7387\u3002\u673a\u7406\u7814\u7a76\u8868\u660e\uff0c1,10-\u83f2\u7f57\u5549-\u4e9a\u80fa\u914d\u4f53\u521a\u6027\u7ed3\u6784\u3001\u94c1\u79bb\u5b50\u7684\u8f83\u5c0f\u79bb\u5b50\u534a\u5f84\u3001\u94c1\u50ac\u5316\u5242\u7684\u5f00\u58f3\u5c42\u7ed3\u6784\u5bf9\u4e8e\u53cd\u5e94\u53d6\u5f97\u4f18\u5f02\u7ed3\u679c\u81f3\u5173\u91cd\u8981\u3002\u8be5\u7814\u7a76\u62d3\u5c55\u4e86\u94c1\u50ac\u5316\u53cd\u5e94\u7684\u7c7b\u578b\uff0c\u6df1\u5316\u4e86\u5bf9\u94c1\u50ac\u5316\u53cd\u5e94\u673a\u7406\u7684\u7406\u89e3\uff0c\u4e30\u5bcc\u4e86\u6709\u673a\u950c\u7684\u5408\u6210\u65b9\u6cd5\u548c\u79cd\u7c7b\u3002<\/p>\n","protected":false},"excerpt":{"rendered":"
\u94c1\u50ac\u5316\u7684\u7aef\u7094\u4e59\u70ef\u57fa\u950c\u5316\u53cd\u5e94 \u6709\u673a\u950c\u8bd5\u5242\u662f\u73b0\u4ee3\u5408\u6210\u5316\u5b66\u6700\u5e38\u7528\u7684\u91d1\u5c5e\u8bd5\u5242\u4e4b\u4e00\u3002\u7094\u70c3\u7684\u78b3\u950c\u5316\u53cd\u5e94\u662f\u5408\u6210\u6709\u673a\u950c\u8bd5\u5242\u7684\u91cd\u8981\u65b9\u6cd5\uff0c\u4f46\u662f\u76ee\u524d\u666e\u904d\u5b58\u5728\u65e0\u6cd5\u8010… <\/p>\n","protected":false},"author":2,"featured_media":4539,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[3],"tags":[],"class_list":["post-4538","post","type-post","status-publish","format-standard","has-post-thumbnail","hentry","category-news"],"_links":{"self":[{"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/posts\/4538","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/posts"}],"about":[{"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/types\/post"}],"author":[{"embeddable":true,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/users\/2"}],"replies":[{"embeddable":true,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/comments?post=4538"}],"version-history":[{"count":1,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/posts\/4538\/revisions"}],"predecessor-version":[{"id":4542,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/posts\/4538\/revisions\/4542"}],"wp:featuredmedia":[{"embeddable":true,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/media\/4539"}],"wp:attachment":[{"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/media?parent=4538"}],"wp:term":[{"taxonomy":"category","embeddable":true,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/categories?post=4538"},{"taxonomy":"post_tag","embeddable":true,"href":"https:\/\/www.51qiguang.com\/wp-json\/wp\/v2\/tags?post=4538"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}