HRID215234

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID888

Magnesium cation

Mg+2

HCID923

Sodium ion

Na+

HCID1117

Sulfate

O4S-2

HCID14272

3-Vinylpyridine

C7H7N

HCID31275

1,4-Dioxane

C4H8O2

HCID4574913

未命名化合物

HCID67240163

未命名化合物

结构：CC(C)(C)[PH]([Pd][PH](C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C

HCID178454917

未命名化合物

PRODUCTS

生成物

结构：C(=Cc1cccc2c3c([nH]c12)C1CCN(CC1)C3)c1cccnc1

HCID67240100

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0d230bd351cc43fd9789ef4096b0d98c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[Br:15][c:16]1[cH:17][cH:18][cH:19][c:20]2[c:21]3[c:22]([nH:23][c:24]12)[CH:25]1[CH2:26][CH2:27][N:28]([CH2:29]3)[CH2:30][CH2:31]1.[C:38]([PH:39]([Pd:40][PH:41]([C:42]([CH3:43])([CH3:44])[CH3:45])([C:46]([CH3:47])([CH3:48])[CH3:49])[C:50]([CH3:51])([CH3:52])[CH3:53])([C:54]([CH3:55])([CH3:56])[CH3:57])[C:58]([CH3:59])([CH3:60])[CH3:61])([CH3:62])([CH3:63])[CH3:64].[CH2:65]1[O:66][CH2:67][CH2:68][O:69][CH2:70]1.[CH3:9][C:10]([CH3:11])([O-:12])[CH3:13].[CH:1](=[CH2:2])[c:3]1[cH:4][n:5][cH:6][cH:7][cH:8]1.[Mg+2:32].[Na+:14].[O-:33][S:34](=[O:35])(=[O:36])[O-:37]>>[CH:1](=[CH:2][c:16]1[cH:17][cH:18][cH:19][c:20]2[c:21]3[c:22]([nH:23][c:24]12)[CH:25]1[CH2:26][CH2:27][N:28]([CH2:29]3)[CH2:30][CH2:31]1)[c:3]1[cH:4][n:5][cH:6][cH:7][cH:8]1