基本情報
- CAS
204906-20-7- 標準SMILES
CC(CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1)(CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1)CP(c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1.O=S(=O)([O-])C(F)(F)F.[C-]#[O+].[C-]#[O+].[Rh]- InChIKey
CFGZZTWQERTIEI-UHFFFAOYSA-M- 分子式
- C50H33F21O5P3RhS-
- 平均分子量
- 1,340.7 g/mol
- 単同位体質量
- 1,339.99812
名称と識別子
- 優先名称
- (Rh(CO)2(CF3PPP))(OTf)
- IUPAC
- [3-bis[3-(trifluoromethyl)phenyl]phosphanyl-2-[bis[3-(trifluoromethyl)phenyl]phosphanylmethyl]-2-methylpropyl]-bis[3-(trifluoromethyl)phenyl]phosphane;carbon monoxide;rhodium;trifluoromethanesulfonate
名称と別名
(Rh(CO)2(CF3PPP))(OTf)204906-20-7[Rh(CO)2(CF3PPP)](OTf)Rhodium(1+), ((2-((bis(3-(trifluoromethyl)phenyl)phosphino-kappaP)methyl)-2-methyl-1,3-propanediyl)bis(bis(3-(trifluoromethyl)phenyl)phosphine-kappaP))dicarbonyl-, (TB-5-12)-, salt with trifluoromethanesulfonic acid (1:1)[3-bis[3-(trifluoromethyl)phenyl]phosphanyl-2-[bis[3-(trifluoromethyl)phenyl]phosphanylmethyl]-2-methyl-propyl]-bis[3-(trifluoromethyl)phenyl]phosphane; carbon monoxide; rhodium(1+); trifluoromethanesulfonic acidRhodium(1+), [[2-[[bis[3-(trifluoromethyl)phenyl]phosphino- .kappa.P]methyl]-2-methyl-1,3-propanediyl]bis[bis[3-(trifluoromethyl)phenyl]phosphine-.kappa.P]]dicarbonyl-, (TB-5-12)-, salt with trifluoromethanesulfonic acid (1:1)
データベース識別子
- CAS
204906-20-7- PubChem CID
- 492252
物性
構造計算による物性
- 極性表面積
- 67.6 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 26
- 回転可能結合数
- 12
- 重原子数
- 81
- 形式電荷
- -1
- 複雑度
- 1,450
関連反応
0 件
現在のフィルター条件では反応記録がありません。
化合物ノート
読み込み中…