Two large-pore metal-doped aluminophosphates, Mn4Al5（PO4 ）12[N（ C2H4NH3）3]3 [ N（C2H4NH3）2·（C2H4NH2）]（NH4）2·14H=O（Mn4-NJU） and Co4Al5（PO4）12[N（C2H,NH3）3][N（C2H4NH3）2（C2H4NH2）]3· （ N...Two large-pore metal-doped aluminophosphates, Mn4Al5（PO4 ）12[N（ C2H4NH3）3]3 [ N（C2H4NH3）2·（C2H4NH2）]（NH4）2·14H=O（Mn4-NJU） and Co4Al5（PO4）12[N（C2H,NH3）3][N（C2H4NH3）2（C2H4NH2）]3· （ NH4 ）4· 13H2O （ Co4-NJU） , which have the same open framework structures, were hydrothermally synthesized. The structures of these compounds consist of TO4 tetrahedra, which are linked together by corner-sharing to form an open framework with unique intersecting twelve-membered ring channels in three dimensions. The compounds crystallize in cubic space group I（-4）3m with α= 1. 6795（2） nm and V=4. 7374（9） nm^3 for Mn4-NJU, and a=1. 67372（19） nm and V = 4. 6887 （9） nm^3 for Co4-NJU, respectively. Single crystal structure analyses show that the protruding O atoms of the frameworks of the compounds are linked to protonated 4-（ 2-aminoethyl ）diethylenetriamine （TREN, C6H18N4 ） ions in the windows by means of hydrogen-bonding under the hydrothermal condition. It is also found that the components inside the super cages of the compounds are changeable, and the metal ions M^2＋ （M = Mn, Co） and Al^3＋ disorderedly occupy the same crystallographic positions.展开更多
Crystal structure of the title compound, macrocyclic tetrabenzo(b ,f,J, n ) [ 1, 5, 9, 1 3] tetraazacyclohexadecine (TAAB ) N, N'-dimethyl formamide(DMF) ruthenium (Ⅱ) complex, [Ru (taab) (DMF )_2]·[ (ClO_4 ...Crystal structure of the title compound, macrocyclic tetrabenzo(b ,f,J, n ) [ 1, 5, 9, 1 3] tetraazacyclohexadecine (TAAB ) N, N'-dimethyl formamide(DMF) ruthenium (Ⅱ) complex, [Ru (taab) (DMF )_2]·[ (ClO_4 )_2](C_(34) H_(34)Cl)2N_6O_(10)Ru , M_r= 874. 66) is monoclinic with space group C2/c and a =36. 689(2) , b=18. 173 (8 ),. c= 10. 666(3)A, β=102. 6(4)°, V=6939. 6 A￣3 , D_c= 1. 67 gcm￣(-3), Z=8. The structural solutions and refinements based on 3183 reflections (I≥3σ(I)) converged at R= 0. 071 , R_w = 0. 074. The TAAB macrocyclic ligand has a saddle-shaped appearance,the ruthenium(Ⅱ) is located on the plane of the four nitrogen atoms of the TAAB with the two perpendicular Ru(Ⅱ)-O bonds coordinated to the DMF molecules.展开更多
Nitrobenzaldehyde thiosemicarbazone (C_8H_8N_4O_2S) has been prepared by the condensation of 4-nitrobenzaldehyde with thiosemicarbazide. This compound crystallized in monoclinic space group P2_1/c with the unit cell p...Nitrobenzaldehyde thiosemicarbazone (C_8H_8N_4O_2S) has been prepared by the condensation of 4-nitrobenzaldehyde with thiosemicarbazide. This compound crystallized in monoclinic space group P2_1/c with the unit cell parameters : a =4. 560(2), b=24. 900(4), c=8. 950(2) A, β=98. 37(2)°, V=1005. 2 A￣3, Z=4,D_c = 1. 482 g/cm￣3, λ= 0. 71073 A, μ(MoKα)=0. 293 mm￣(-1) , final R= 0.044 for 1568 observed reflections. Analvsis of molecular structure reveals that the molecule is in trans-configuration. The molecular packing is governed by N-H...S and O... H-N hydrogen bonding interactions.展开更多
The title complex, mercury bridged biferrocene trinuclear complex Hg(FcL)2. Bis (S-methyl-N- (1-ferrocenyl-1-methyl) methylenedithiocarbazate) mercury,Crystallizes in space group Pbca with a =19. 510 (4), b=19. 921 (5...The title complex, mercury bridged biferrocene trinuclear complex Hg(FcL)2. Bis (S-methyl-N- (1-ferrocenyl-1-methyl) methylenedithiocarbazate) mercury,Crystallizes in space group Pbca with a =19. 510 (4), b=19. 921 (5), c=15. 581 (3)A. V=6095(3) A, Z=8,M.=863. 12, Dc=1.881 g/cm3; u=19. 24 cm-1 and F(000) = 3376. The final refinement of 2455 observed reflections is converged with R= 0. 043 and Rw=0.047. X-ray crystal structure analysis revealed that the coordinationgeometry of Hg atom is a distorted tetrahedron with two Hg-N bonds and two Hg- S bonds. The Schiff-base ligand loses a proton from its tautomeric thiol form and is cryordianted to the Hg aotm uia the mercapto sulphur and the β-nitrogen atoms.展开更多
文摘Two large-pore metal-doped aluminophosphates, Mn4Al5（PO4 ）12[N（ C2H4NH3）3]3 [ N（C2H4NH3）2·（C2H4NH2）]（NH4）2·14H=O（Mn4-NJU） and Co4Al5（PO4）12[N（C2H,NH3）3][N（C2H4NH3）2（C2H4NH2）]3· （ NH4 ）4· 13H2O （ Co4-NJU） , which have the same open framework structures, were hydrothermally synthesized. The structures of these compounds consist of TO4 tetrahedra, which are linked together by corner-sharing to form an open framework with unique intersecting twelve-membered ring channels in three dimensions. The compounds crystallize in cubic space group I（-4）3m with α= 1. 6795（2） nm and V=4. 7374（9） nm^3 for Mn4-NJU, and a=1. 67372（19） nm and V = 4. 6887 （9） nm^3 for Co4-NJU, respectively. Single crystal structure analyses show that the protruding O atoms of the frameworks of the compounds are linked to protonated 4-（ 2-aminoethyl ）diethylenetriamine （TREN, C6H18N4 ） ions in the windows by means of hydrogen-bonding under the hydrothermal condition. It is also found that the components inside the super cages of the compounds are changeable, and the metal ions M^2＋ （M = Mn, Co） and Al^3＋ disorderedly occupy the same crystallographic positions.
文摘Crystal structure of the title compound, macrocyclic tetrabenzo(b ,f,J, n ) [ 1, 5, 9, 1 3] tetraazacyclohexadecine (TAAB ) N, N'-dimethyl formamide(DMF) ruthenium (Ⅱ) complex, [Ru (taab) (DMF )_2]·[ (ClO_4 )_2](C_(34) H_(34)Cl)2N_6O_(10)Ru , M_r= 874. 66) is monoclinic with space group C2/c and a =36. 689(2) , b=18. 173 (8 ),. c= 10. 666(3)A, β=102. 6(4)°, V=6939. 6 A￣3 , D_c= 1. 67 gcm￣(-3), Z=8. The structural solutions and refinements based on 3183 reflections (I≥3σ(I)) converged at R= 0. 071 , R_w = 0. 074. The TAAB macrocyclic ligand has a saddle-shaped appearance,the ruthenium(Ⅱ) is located on the plane of the four nitrogen atoms of the TAAB with the two perpendicular Ru(Ⅱ)-O bonds coordinated to the DMF molecules.
文摘Nitrobenzaldehyde thiosemicarbazone (C_8H_8N_4O_2S) has been prepared by the condensation of 4-nitrobenzaldehyde with thiosemicarbazide. This compound crystallized in monoclinic space group P2_1/c with the unit cell parameters : a =4. 560(2), b=24. 900(4), c=8. 950(2) A, β=98. 37(2)°, V=1005. 2 A￣3, Z=4,D_c = 1. 482 g/cm￣3, λ= 0. 71073 A, μ(MoKα)=0. 293 mm￣(-1) , final R= 0.044 for 1568 observed reflections. Analvsis of molecular structure reveals that the molecule is in trans-configuration. The molecular packing is governed by N-H...S and O... H-N hydrogen bonding interactions.
文摘The title complex, mercury bridged biferrocene trinuclear complex Hg(FcL)2. Bis (S-methyl-N- (1-ferrocenyl-1-methyl) methylenedithiocarbazate) mercury,Crystallizes in space group Pbca with a =19. 510 (4), b=19. 921 (5), c=15. 581 (3)A. V=6095(3) A, Z=8,M.=863. 12, Dc=1.881 g/cm3; u=19. 24 cm-1 and F(000) = 3376. The final refinement of 2455 observed reflections is converged with R= 0. 043 and Rw=0.047. X-ray crystal structure analysis revealed that the coordinationgeometry of Hg atom is a distorted tetrahedron with two Hg-N bonds and two Hg- S bonds. The Schiff-base ligand loses a proton from its tautomeric thiol form and is cryordianted to the Hg aotm uia the mercapto sulphur and the β-nitrogen atoms.
