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MOF晶體解析后分子式出現(xiàn)了小數(shù),無法變成整數(shù),請問應該取整數(shù)還是保留小數(shù)
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Your assessment must be backed up relevant independent data such as TGA. Please note that your final reported sum formula must contain all entities present in your crystal, including those that have been solvent-masked. 單晶得到的Empirical formula有小數(shù),晶體的Empirical formula為C16.18 H8.54 O8 S3.59 Lu,無法通過改變Z值化整,這個應該怎么處理呢?審稿人的要求是根據(jù)熱重算出最終的分子式(包含未配位的溶劑分子),但從現(xiàn)在的Empirical formula沒法得到骨架中金屬,配體,溶劑分子合理的具體個數(shù) |
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