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yinguojie

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[求助] 审稿中的两个意见不知道怎么处理

2. last sentence: the Cg...Cg distance and symmetry operations must be given.

However, the two oxazole units have two five-membered and six six-membered rings. this implies a lot of work defining the centres of gravity (Cg's) for the rings and calculating the distances between Cg's and average perpendicular distances between the ring systems. Moreover, your Fig. 2 does not show the inversion related \p--\p
interaction clearly, and the symmetry operators for molecule A and molecule B should also be provided in the caption of Figure 2.

You need a programme like PLATON which can help analize
this problem by using the "cal all" option. It will also be seen that the complexes
are held together by a combination of different \p--\p interactions and a C---H...\p
contact when PLATON is applied. (see point 9)

The best was to delete the sentence in Abstract
... exhibits obvious intermolecular \p--\p interactions and also delete Fig. 2.
Otherwise, details must be calculated, which needs time ...
IMPORTANT: all numerical measured values need standard uncertainties (s.u.), which will be described for the Comment section.


6. Comment: please think of having two oxazol ligands, so the average
deviation of Ir1 C18 C23 C24 N2 and the dihedral angles as for molecule 1(average is 0.0628 and 0.0719 (typo mol. 1, please check, and mol. 2) the s.u.'s for dihedral angles in parentheses: 6.5(2)\%  (6.9(1)\% for mol.2), 9.2(1)\% (11.4(1)\% for mol. 2). please check with MPLA in SHELXL97.
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lin_twins

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【答案】应助回帖

yinguojie(金币+10): 3Q 2011-08-18 21:19:10
可能你有的数据有问题,评审建议你用PLATON这个软件,重新算一下的。
如果不是很懂,建议你发到晶体板块和那里的人讨论下。软件那里也有
记忆像是掌心里的水,不论你摊开还是紧握,终究还是会从指缝中一滴一滴流淌干净。
8楼2011-08-18 21:16:27
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cgetlc

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【答案】应助回帖

yinguojie(金币+1): 2011-08-18 16:13:36
太专业,没办法给意见,请LZ说明大致意思吧
2楼2011-08-18 16:09:54
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yinguojie

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引用回帖:
2楼: Originally posted by cgetlc at 2011-08-18 16:09:54:
太专业,没办法给意见,请LZ说明大致意思吧

我要是知道的话就不问了

我自己也不是很清楚的
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3楼2011-08-18 16:13:27
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cgetlc

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yinguojie(金币+1): 2011-08-18 16:58:40
里面的 \p--\p 、Ir1 C18 C23 C24 N2 等等不知道是啥?
4楼2011-08-18 16:15:57
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