The compound of 3,5-diazido-1,2,4-triazole was synthesized by the reaction of 2,5,2',5'-tetrachloro-1,1'-azo-1,3,4-triazole with sodium azide at 50 ℃.Its crystal structure was determined by single-crystal X-ray di...The compound of 3,5-diazido-1,2,4-triazole was synthesized by the reaction of 2,5,2',5'-tetrachloro-1,1'-azo-1,3,4-triazole with sodium azide at 50 ℃.Its crystal structure was determined by single-crystal X-ray diffraction.It crystallizes in monoclinic,space group Cc with a=1.212 4(2) nm,b=2.342 4(5) nm,c=0.804 74(16) nm,β=125.56(3)°,V=1.859 3(6) nm3,Z=4,C2HN9,Mr=151.04,Dc=1.62 g/cm3,F(000)=912 and μ(MoKa)=0.129 mm-1,the final R=0.039 7 and wR=0.087 4.X-ray analysis indicates a stronger intermolecular hydrogen bonding,leading to the formation of a trimmer,containing a nine-membered cyclic ring with graph-set R33(9) in the compound.展开更多
The reaction of 4-amino-3,5-bis(imidazol-l-ylmethyl)-1,2,4-triazole (abit) and manganese(Ⅱ) salts yields four coordination polymers {[Mn(abit)3](C104)z}n (1), {[Mn(abit)3](PF6)2},, (2), [Mn(abit)...The reaction of 4-amino-3,5-bis(imidazol-l-ylmethyl)-1,2,4-triazole (abit) and manganese(Ⅱ) salts yields four coordination polymers {[Mn(abit)3](C104)z}n (1), {[Mn(abit)3](PF6)2},, (2), [Mn(abit)(dca)2(H2O)2],, (3a) and [Mn(abit)(dca)2(H2O)2]n (3b). Compounds 1 and 2 are one-dimensional triple-stranded chain. Compounds 3a and 3b are polymorphous and construct one-dimensional single chain. The conformational analysis is performed. The thermal properties have been investigated.展开更多
Reaction of FeCIz'6H20, pyridine-2,4,6-tricarboxylic acid(H3pyta) and NaOH in the hydrothermal system at 185 ℃ resulted in the formation of 1D coordination polymer[Fe(Hpyta)(H2O)2](1) based on Fe-Hpyta chain...Reaction of FeCIz'6H20, pyridine-2,4,6-tricarboxylic acid(H3pyta) and NaOH in the hydrothermal system at 185 ℃ resulted in the formation of 1D coordination polymer[Fe(Hpyta)(H2O)2](1) based on Fe-Hpyta chains. When the abpt[abpt=-4-amino-3,5-bis(4-pyridyl)-l,2,4-triazole] ligand was employed in the reaction system, a 3D supramolecular porous network (H2bpt)[Fe(pyta)(H2O)2]·4H2O(2) was obtained. The framework was constructed with negative (Fe-pyta) chains and the positive H3bpt^+ in situ, formed from the abpt reagent, to form 1D channels filled with guest water molecules via hydrogen-bonds. X-Ray diffraction crystal structure analysis shows that complex 1 crystallized in the monoclinic system, space group C2/c, a=1.1490(5) nm, b=0.9008(4) nm, c=1.0058(5) nm, B=107.254(9)°, V=0.9942(8) nm3, Z=4; and complex 2 crystallizes in the triclinic system, space group P1 with a=0.90392(11) nm, b=0.96027(11 ) nm, c=1.55540(18) nm, a=73.558(2)°,B= 86.126(2)°,r= 68.745(2)°, V=1.2059(2) nm^3 and Z=2.展开更多
基金Supported by the Program for New Century Excellent Talentsin University (NCET-09-0046)
文摘The compound of 3,5-diazido-1,2,4-triazole was synthesized by the reaction of 2,5,2',5'-tetrachloro-1,1'-azo-1,3,4-triazole with sodium azide at 50 ℃.Its crystal structure was determined by single-crystal X-ray diffraction.It crystallizes in monoclinic,space group Cc with a=1.212 4(2) nm,b=2.342 4(5) nm,c=0.804 74(16) nm,β=125.56(3)°,V=1.859 3(6) nm3,Z=4,C2HN9,Mr=151.04,Dc=1.62 g/cm3,F(000)=912 and μ(MoKa)=0.129 mm-1,the final R=0.039 7 and wR=0.087 4.X-ray analysis indicates a stronger intermolecular hydrogen bonding,leading to the formation of a trimmer,containing a nine-membered cyclic ring with graph-set R33(9) in the compound.
基金Project supported by the National Natural Science Foundation of China (No. 20671066), the Jiangsu Province (No. BK2006049), and the Funds of Key Laboratory of Organic Synthesis of Jiangsu Province.
文摘The reaction of 4-amino-3,5-bis(imidazol-l-ylmethyl)-1,2,4-triazole (abit) and manganese(Ⅱ) salts yields four coordination polymers {[Mn(abit)3](C104)z}n (1), {[Mn(abit)3](PF6)2},, (2), [Mn(abit)(dca)2(H2O)2],, (3a) and [Mn(abit)(dca)2(H2O)2]n (3b). Compounds 1 and 2 are one-dimensional triple-stranded chain. Compounds 3a and 3b are polymorphous and construct one-dimensional single chain. The conformational analysis is performed. The thermal properties have been investigated.
基金the Scientific and Technological Project of Guangdong Province, China(No.2006B36703005)
文摘Reaction of FeCIz'6H20, pyridine-2,4,6-tricarboxylic acid(H3pyta) and NaOH in the hydrothermal system at 185 ℃ resulted in the formation of 1D coordination polymer[Fe(Hpyta)(H2O)2](1) based on Fe-Hpyta chains. When the abpt[abpt=-4-amino-3,5-bis(4-pyridyl)-l,2,4-triazole] ligand was employed in the reaction system, a 3D supramolecular porous network (H2bpt)[Fe(pyta)(H2O)2]·4H2O(2) was obtained. The framework was constructed with negative (Fe-pyta) chains and the positive H3bpt^+ in situ, formed from the abpt reagent, to form 1D channels filled with guest water molecules via hydrogen-bonds. X-Ray diffraction crystal structure analysis shows that complex 1 crystallized in the monoclinic system, space group C2/c, a=1.1490(5) nm, b=0.9008(4) nm, c=1.0058(5) nm, B=107.254(9)°, V=0.9942(8) nm3, Z=4; and complex 2 crystallizes in the triclinic system, space group P1 with a=0.90392(11) nm, b=0.96027(11 ) nm, c=1.55540(18) nm, a=73.558(2)°,B= 86.126(2)°,r= 68.745(2)°, V=1.2059(2) nm^3 and Z=2.