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[求助]
文章回消息了,但是有地方不知道怎么修改,求大神帮忙看看!谢谢已有1人参与
2.3 Structure determination.
Structural data of 1-3 were collected on a Bruker APEX-II CCD diffractometer with graphite monochromatic Mo-Kα radiation (λ = 0.71073 Å at room temperature. All of the structures were solved by direct method20 and refined with the full-matrix least-squares procedures on F2 using the SHELXS-9721 and SHELXL-97 programs22, respectively. All non-hydrogen atoms were refined anisotropically except some free solvent molecules, and all the hydrogen atom positions were generated geometrically at idealized positions and refined by using the riding model. Details of the crystal parameters, data collection, and refinements for compounds 1-3 are summarized in Table 1. Selected bond lengths and angles are listed in Table S1-S3. CCDC numbers 989823, 989824, 989821 for complexes 1–3.
问题;2.3水分子的加氢方式应予说明!配体3分子式不正确,核实修改!配体3没有不对称电子何来磁性!
附件:[Cd(L)(obba)]•H2O (1), [Co(L)(obba)]•MeCN (2) and [Cd2(L)2(ip)2•4O]•2H2O•DMF (3), (H2obba = 4, 4-Oxybisbenzoic acid, H2ip = m-Phthalic acid) 9-ethyl-3,6-diimidazolyl-carbazole(L)
配体结构跟原始数据都在![文章回消息了,但是有地方不知道怎么修改,求大神帮忙看看!谢谢]()
配体.png |
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- 附件 1 : 1.cif
2016-02-22 20:00:41, 25.84 K
- 附件 2 : 2.cif
2016-02-22 20:00:42, 25.56 K
- 附件 3 : 3.cif
2016-02-22 20:00:43, 42.4 K
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