Bromide ion → HCID 67395862, compound
Reaction equation
[Br-:18].[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6](-[c:8]2[nH:9][c:10](=[O:17])[c:11]3[c:12]([n:13]2)[s:14][cH:15][cH:16]3)[n:7]1.[CH2:19]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[Zn+:26].[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[Pd:32].[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1.[c:52]1([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[cH:66][cH:67][cH:68][cH:69][cH:70]1.[c:71]1([P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[cH:85][cH:86][cH:87][cH:88][cH:89]1.[c:90]1([P:91]([c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)[cH:104][cH:105][cH:106][cH:107][cH:108]1>>[c:2]1([CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:3][cH:4][cH:5][c:6](-[c:8]2[nH:9][c:10](=[O:17])[c:11]3[c:12]([n:13]2)[s:14][cH:15][cH:16]3)[n:7]1Participants
7
Sources & evidence
- ORD record
- ord-45ceb6b367d74cd38ac913df96cfff71
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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