(μ-FcC≡CH)Co_2(CO)_6簇合物羰基取代衍生物的合成和分子结构  

Synthesis and Molecular Structure of Substituted Derivatives from (μ-FcC≡CH)Co_2(CO)_6 cluster

作　　者：冶杰慧[1] 索全伶[1] 王一兵[1] 韩利民[1] 冷雪冰[2] 

机构地区：[1]内蒙古工业大学化工学院,呼和浩特010062 [2]南开大学元素有机化学研究所,天津300071

出　　处：《无机化学学报》2004年第5期559-562,共4页Chinese Journal of Inorganic Chemistry

基　　金：留学回国人员启动基金(No.教外司留2001鄄345);内蒙古自然科学基金(No.200208020113);内蒙古人才基金;内蒙古工业大学校基金资助项目。

摘　　要：The substituted reactions of (μ-FcC≡CH)Co2(CO)6 with PPh3, AsPh3 and dppm have been studied and three new substituted derivatives have been obtained. The compounds were characterized by elemental analysis, IR, 1H NMR, MS and X-ray crystallography. They have the following formula: (μ-FcC≡CH)Co2(CO)6-nL[n=1, L=PPh3(2), AsPh3 (3); n=2, L=dppm (4)]. The cluster 2 crystallizes in monoclinic, space group P21/n, with a=1.342 4(8) nm, b=1.305 4(8) nm, c=1.875 0(9) nm, β=103.084(9)°, V=3.201(3) nm3, Z=4, F(000)=1 480, Dc=1.515 g·cm-3, μ=15.62 cm-1; final R indices [I > 2σ(I)]: R1=0.040 9, ωR2=0.076 9; S=1.007, Δρmax=463 e·nm-3, Δρmin=-395 e·nm-3. The cluster 3 crystallizes in monoclinic, space group P21/n, with a=1.341 0(4) nm, b=1.307 9(4) nm, c=1.912 0(5) nm, β=103.043(5)°, V=3.267(15) nm3, Z=4, F(000)=1 552, Dc=1.574 g·cm-3, μ=24.87 cm-1; final R indices[I > 2σ(I)]:R1=0.043 7, ωR2=0.078 2; S=0.995, Δρmax=530 e·nm-3, Δρmin=-444 e·nm-3. CCDC: 221860, 2; 221863, 3.The substituted reactions of (μ-FcC≡CH)Co2(CO)6 with PPh3, AsPh3 and dppm have been studied and three new substituted derivatives have been obtained. The compounds were characterized by elemental analysis, IR, 1H NMR, MS and X-ray crystallography. They have the following formula: (μ-FcC≡CH)Co2(CO)6-nL[n=1, L=PPh3(2), AsPh3 (3); n=2, L=dppm (4)]. The cluster 2 crystallizes in monoclinic, space group P21/n, with a=1.342 4(8) nm, b=1.305 4(8) nm, c=1.875 0(9) nm, β=103.084(9)°, V=3.201(3) nm3, Z=4, F(000)=1 480, Dc=1.515 g·cm-3, μ=15.62 cm-1; final R indices [I > 2σ(I)]: R1=0.040 9, ωR2=0.076 9; S=1.007, Δρmax=463 e·nm-3, Δρmin=-395 e·nm-3. The cluster 3 crystallizes in monoclinic, space group P21/n, with a=1.341 0(4) nm, b=1.307 9(4) nm, c=1.912 0(5) nm, β=103.043(5)°, V=3.267(15) nm3, Z=4, F(000)=1 552, Dc=1.574 g·cm-3, μ=24.87 cm-1; final R indices[I > 2σ(I)]:R1=0.043 7, ωR2=0.078 2; S=0.995, Δρmax=530 e·nm-3, Δρmin=-444 e·nm-3. CCDC: 221860, 2; 221863, 3.

关 键 词：二茂铁乙炔基钴羰基簇合物 合成 分子结构 晶体结构 

分 类 号：O614.812[理学—无机化学] O627.81[理学—化学]