HRID948268

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID4650

1,4-Benzoquinone

C6H4O2

HCID6228

N,N-Dimethylformamide

C3H7NO

结构：O=[N+]([O-])c1cc([N+](=O)[O-])c(CCc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1

HCID138431

2,2',4,4',6,6'-Hexanitrodibenzyl

C14H8N6O12

PRODUCTS

生成物

HCID253628

1,1′-(1,2-Ethenediyl)bis[2,4,6-trinitrobenzene]

C14H6N6O12

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4aa3c3f8880e4ed8a177eb1ad0aefda8
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:33]1(=[O:34])[CH:35]=[CH:36][C:37](=[O:38])[CH:39]=[CH:40]1.[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:16][CH2:17][c:18]2[c:19]([N+:30](=[O:31])[O-:32])[cH:20][c:21]([N+:27](=[O:28])[O-:29])[cH:22][c:23]2[N+:24](=[O:25])[O-:26])[c:6]([N+:13](=[O:14])[O-:15])[cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:52].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH:16]=[CH:17][c:18]2[c:19]([N+:30](=[O:31])[O-:32])[cH:20][c:21]([N+:27](=[O:28])[O-:29])[cH:22][c:23]2[N+:24](=[O:25])[O-:26])[c:6]([N+:13](=[O:14])[O-:15])[cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1