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灯泡3204

木虫 (著名写手)

[求助] _refine_ls_abs_structure_Flack 0.2(11) 绝对构型能定吗?

_refine_ls_abs_structure_Flack 0.2(11)   绝对构型能定吗?
cifcheck时出现B类错误,提示绝对构型,Please Do!
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祎璠

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【答案】应助回帖

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感谢参与,应助指数 +1
灯泡3204: 金币+5, ★★★很有帮助 2013-11-01 06:59:22
0.2已经不能确定了,更何况你的误差还那么大
3楼2013-10-31 22:21:31
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灯泡3204

木虫 (著名写手)

Alert level B
PLAT029_ALERT_3_B _diffrn_measured_fraction_theta_full Low .......      0.943      
PLAT035_ALERT_1_B No _chemical_absolute_configuration info given .     Please Do !
2楼2013-10-31 19:10:29
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灯泡3204

木虫 (著名写手)

引用回帖:
3楼: Originally posted by 祎璠 at 2013-10-31 22:21:31
0.2已经不能确定了,更何况你的误差还那么大

第一个错误是不是按http://muchong.com/bbs/viewthread.php?tid=6531384&fpage=1说的修改?
4楼2013-11-01 06:58:59
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