HRID1569990

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID223

Ammonia ion (NH4+)

H4N+

HCID259

Bromide

Br-

HCID312

Chloride

Cl-

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID11074154

5,7-Dichloropyrazolo[1,5-a]pyrimidine

C6H3Cl2N3

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

HCID178509755

未命名化合物

PRODUCTS

生成物

HCID86654653

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ecb01b7e9e5f426b9247881a880187e3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br-:12].[C:13](#[N:14])[c:15]1[cH:16][c:17]([CH2:18][Zn+:19])[cH:20][cH:21][cH:22]1.[Cl-:23].[Cl:1][c:2]1[n:3][c:4]2[n:5]([c:6]([Cl:8])[cH:7]1)[n:9][cH:10][cH:11]2.[NH4+:24].[O:102]=[CH:103][N:104]([CH3:105])[CH3:106].[cH:25]1[cH:26][cH:27][c:28]([P:29]([Pd:30]([P:31]([c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)([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)([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([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)[P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([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)[cH:100][cH:101]1>>[c:2]1([CH2:18][c:17]2[cH:16][c:15]([C:13]#[N:14])[cH:22][cH:21][cH:20]2)[n:3][c:4]2[n:5]([c:6]([Cl:8])[cH:7]1)[n:9][cH:10][cH:11]2