HRID1127885

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID5975

Cyanide

CN-

HCID31275

1,4-Dioxane

C4H8O2

结构：Cc1cc(OS(=O)(=O)C(F)(F)F)cc(-c2ccccc2)c1

HCID18474574

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

HCID18474544

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-88bf3c4f75f84e929b8498ad05230934
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[C-:22]#[N:23].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][c:9]([CH3:19])[cH:10][c:11](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:12]1)(=[O:20])=[O:21].[K+:24].[O:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1.[cH:31]1[cH:32][cH:33][c:34]([P:35]([Pd:36]([P:37]([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([P:56]([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)([c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)[c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)[P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[cH:106][cH:107]1>>[c:7]1([C:22]#[N:23])[cH:8][c:9]([CH3:19])[cH:10][c:11](-[c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)[cH:12]1