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| Content Provider | Springer Nature Link |
|---|---|
| Author | Song, Jirong Chen, Zhaoxu Xiao, Heming Hu, Rongzu Li, Fuping |
| Copyright Year | 1999 |
| Abstract | [Li(NTO)(H$_{2}$O)$_{2}$] was prepared by mixing the aqueous solution of 3-nitro-1,2,4-triazol-5-one (NTO) and lithium hydroxide. The crystal structure of [Li(NTO)(H$_{2}$O)$_{2}$] was determined by single crystal diffraction analysis. The crystal is monoclinic, space group P2$_{1}$/n with crystal parameters of a = 0.742 0(2) nm, b = 0.344 9(1) nm,c = 2.490 6(3) nm, β= 94.89(1)°, Z = 4,D $_{ c }$, = 1.799 g cm$^{−3}$,V = 0.635 nm$^{3}$, μ = 1.591 cm$^{−1}$, F(000) = 392. The finalR is 0.051. The MNDO MO calculation shows that the coordinate bonds of title compound possess certain extent of covalent character. O$_{2}$ atom of NTO anion is bonded to Li atom; the nitro group will be lost first when NTO is decomposed. |
| Starting Page | 214 |
| Ending Page | 218 |
| Page Count | 5 |
| File Format | |
| ISSN | 10016538 |
| Journal | Chinese Science Bulletin |
| Volume Number | 44 |
| Issue Number | 3 |
| e-ISSN | 18619541 |
| Language | English |
| Publisher | Science in China Press |
| Publisher Date | 1999-01-01 |
| Publisher Place | Beijing |
| Access Restriction | Subscribed |
| Subject Keyword | NTO lithium coordination crystal structure MNDO MO method Science Life Sciences Physics Chemistry/Food Science Geosciences Engineering |
| Content Type | Text |
| Resource Type | Article |
| Subject | Multidisciplinary |
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