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[CuBr(PPh3)(6-cyano-2,2'-bipyridine)] | 1352559-22-8

中文名称
——
中文别名
——
英文名称
[CuBr(PPh3)(6-cyano-2,2'-bipyridine)]
英文别名
[CuBr(PPh3)(cbpy)]
[CuBr(PPh3)(6-cyano-2,2'-bipyridine)]化学式
CAS
1352559-22-8
化学式
C29H22BrCuN3P
mdl
——
分子量
586.938
InChiKey
RQGAPMRDFSGVIA-UHFFFAOYSA-M
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    None
  • 重原子数:
    None
  • 可旋转键数:
    None
  • 环数:
    None
  • sp3杂化的碳原子比例:
    None
  • 拓扑面积:
    None
  • 氢给体数:
    None
  • 氢受体数:
    None

反应信息

  • 作为产物:
    描述:
    6-氰基-2,2'-联吡啶三苯基膦 、 copper(I) bromide 以 二氯甲烷 为溶剂, 以58%的产率得到[CuBr(PPh3)(6-cyano-2,2'-bipyridine)]
    参考文献:
    名称:
    Luminescent mononuclear copper(I) heteroleptic complexes with 6-cyano-2,2′-bipyridine
    摘要:
    A new series of luminescent mononuclear Cu(I) heteroleptic complexes of 6-cyano-2,2'-hipyridine (cbpy), [Cu(cbpy)(PPh3)X] (X=I (1): Br (2)) and [Cu(cbpy)(PPh3)(2)](ClO4) (3), has been synthesized and characterized. It is revealed that phosphine in place of halide results in lengthening of the Cu-P bond from 2.21 angstrom of 1 and 2.19 angstrom of 2 to 2.27 angstrom of 3. Complexes 1-3 display the weak low-energy absorption bands in the 350-600 nm region in dichloromethane, which are assigned to the Cu(I) to cbpy metal-to-ligand charge-transfer (MLCT) transitions, probably mixed with some halide-to-ligand charge-transfer (XLCT) character for 1 and 2. Complexes 1-3 show the solid-state emissions at ambient temperature, varying with the second auxiliary ligand coordinated to the {Cu(cbpy)(PPh3)} motif, which most likely originate from the MLCT excited states, perhaps involving some XLCT character for 1 and 2. (C) 2011 Elsevier B.V. All rights reserved.
    DOI:
    10.1016/j.inoche.2011.09.040
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