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\"1.png\"<\/p>\n

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\"2.png\"<\/p>\n

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\"3.png\"<\/p>\n

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\"4.png\"<\/p>\n

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\"5.png\"<\/p>\n

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\"6.png\"<\/p>\n

\u56fe1.5\u7532\u70f7\u6c14\u4f53\u548c\u5176\u4ed6\u4e0d\u4e00\u6837\u7684\u6c1f\u4ee3\u7532\u70f7\u6c14\u4f53(CH4-n<\/sub>Fn<\/sub>)\u7684\u7194\u70b9(\u2103\uff0c\u6df1\u7070\u8272\u68d2)\u548c\u5076\u6781\u77e9(D),(\u25c6\uff0c\u4ee5\u659c\u4f53\u5b57\u6570\u636e\u5f97\u51fa)<\/p>\n

\"7.png\"<\/p>\n

\u56fe1.6 (a)\u4e00\u90e8\u5206\u6b63\u7535\u8377q(e)\u5728CH4<\/sub>, CH2<\/sub>F2<\/sub>, CF4<\/sub>\u5206\u5b50\u7ed3\u6784\u4e2d\u7684\u5206\u6d3e\u8f83\u4e3a(MP2\/6-31 G**\u57fa\u7840\u7406\u8bba\u6c34\u51c6); (b)\u53cc\u5411\u5171\u4ef7\u952e\u6865\u8054\u7684\u4e8c\u6c1f\u7532\u70f7\u4e8c\u805a\u4f53\u7684\u6d4b\u7b97\u6784\u9020(AM1)\u3002\u6839\u636e\u7535\u5b50\u5668\u4ef6\u7b49\u76f8\u5bf9\u5bc6\u5ea6\u9762\u7684\u9759\u7535\u52bf\u56fe<\/p>\n

\u5728\u82ef\u548c\u5168\u6c1f\u82ef\u4e2d\u95f4\u89c2\u67e5\u5230\u662f\u4e00\u79cd\u4e0d\u4e00\u6837\u79cd\u7c7b\u7684\u5f3a\u9759\u7535\u5f15\u529b(\u76f8\u5173\u8be6\u5c3d\u5167\u5bb9\u5ba2\u6237\u7a0b\u5e8f\u53c2\u8003\u6587\u732e\uff0c\u82ef(\u6eb6\u70b95.5\u2103\uff0c\u7194\u70b980\u2103)\u3001\u5168\u6c1f\u82ef(\u6eb6\u70b93.9\u2103\uff0c\u7194\u70b980.5\u2103),\u4e8c\u8005\u7684\u76f8\u8f6c\u5316\u6eab\u5ea6\u76f8\u4eff\u3002\u6bd4\u8f83\u4e4b\u4e0b\uff0c\u5f53\u4e8c\u8005\u4ee5\u7b49\u514b\u5206\u5b50\u6df7\u548c\u540e\uff0c\u53ef\u4ee5\u4ea7\u751f\u6eb6\u70b9\u4e3a23.7\u2103\u76841:1\u5171\u7ed3\u6676\uff0c\u6bd42\u4e2a\u5355\u4e00\u5316\u5b66\u7269\u8d28\u6eb6\u70b9\u5747\u9ad8\u4e8e\u7ea619\u2103\u3002\u82ef\u548c\u5168\u6c1f\u82ef\u7684\u7ed3\u6676\u5168\u662f\u8fb9\u4e00\u9762\u7259\u5237\u6bdb\u72b6\u6784\u9020\uff0c\u800c\u82ef-\u6c1f\u82ef\u5171\u7ed3\u6676\u5219\u662f\u66f4\u66ff\u504f\u659c\u5e73\u884c\u9762\u6392\u5e8f\u7684\uff0c\u6c89\u79ef\u7684\u5c42\u4e0e\u5c42\u4e2d\u95f4\u95f4\u8ddd\u7ea6\u4e3a3.4Ao<\/sup>\uff0c\u6838\u5fc3\u4e00\u4e2d\u5fc3\u95f4\u8ddd\u7ea6\u4e3a3.7Ao<\/sup>(\u56fe1.7)\u3002\u800c\u90bb\u8fd1\u7684\u6c89\u79ef\u4e2d\u95f4\u53c8\u56e0\u6709Caryl<\/sub>\uff0dH\u2026F\u4e2d\u95f4\u7684\u76f8\u4e92\u5f71\u54cd\u800c\u66f4\u5e73\u7a33\u3002<\/p>\n

\"8.png\"<\/p>\n

\u56fe1.7\u82ef\u548c\u5168\u6c1f\u82ef1:1\u7684\u914d\u5408\u7269\u7684X\u900f\u5c04\u5206\u5b50\u7ed3\u6784\u56fe\uff0c\u572830K\u6700\u4f4e\u6e29\u4e0b\u6d4b\u5f97<\/p>\n

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\"9.png\"<\/p>\n

\u56fe1.8\u82ef(a)(-29.0\u00d710-40<\/sup>C\u00b7m-2<\/sup>)\u548c\u5168\u6c1f\u82ef(b)( 31.7\u00d710-40<\/sup>\u00a0C\u00b7m-2<\/sup>)\u7684\u76f8\u8f85\u76f8\u6210\u56db\u6781\u77e9\u56fe\u793a\u3002\u56fe\u5185\u8272\u8c03\u8868\u660e\u5206\u5b50\u7ed3\u6784\u8868\u5c42\u7684\u9759\u7535\u52bf\u80fd\u56fe(B3LYP\/6-31G*\u57fa\u7840\u7406\u8bba\u6c34\u51c6)\u3002\u82ef(\u6700\u5de6\u4fa7)\u8f83\u5927\u7684\u8d1f\u7535\u7535\u5b50\u5bc6\u5ea6(1)\u5404\u81ea\u5728\u03c0\u7ba1\u7406\u4f53\u7cfb\u5e73\u9762\u56fe\u7684\u4e0a\u4e0b\u8fb9\uff1b\u53cd\u8fc7\u6765\u5728\u5168\u6c1f\u82ef(\u6700\u53f3\u4fa7)\u5e73\u9762\u56fe\u7684\u4e0a\u4e0b\u8fb9\u5219\u662f\u904d\u5e03\u7740\u4e00\u90e8\u5206\u6b63\u7535(2)<\/p>\n

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