The Graham reaction: Deciding upon a "reasonable mechanism".
DOI: 10.14469/hpc/5045 Metadata
Created: 2019-02-16 12:41
Last modified: 2019-04-04 09:49
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
test
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/177 | Computation data for Henry Rzepa's blog |
Members
| DOI | Description |
|---|---|
| 10.14469/hpc/5034 | Haloamidines, NN cyclisation Reactant -1185.034498 |
| 10.14469/hpc/5035 | Haloamidines, NN cyclisation IRC |
| 10.14469/hpc/5036 | Haloamidines, NN cyclisation, Cl migration -1184.986242 |
| 10.14469/hpc/5037 | Haloamidines, NN cyclisation, Cl migration IRC |
| 10.14469/hpc/5038 | Haloamidines, NN cyclisation , Na(H2O)3OH TS |
| 10.14469/hpc/5039 | Haloamidines, NN cyclisation , Na(H2O)3OH IRC |
| 10.14469/hpc/5040 | Haloamidines, NN cyclisation , Na(H2O)3OH Reactant, ionic -1576.246651 |
| 10.14469/hpc/5041 | Haloamidines, NN cyclisation , Na(H2O)3OH Reactant, neutral -1576.246653 |
| 10.14469/hpc/5042 | Haloamidines, NN cyclisation , Na(H2O)5OH TS -1729.156451 |
| 10.14469/hpc/5044 | Haloamidines, NN cyclisation , Na(H2O)5OH IRC |
| 10.14469/hpc/5043 | Haloamidines, NN cyclisation , Na(H2O)5OH Reactant, ionic -1729.171537 |
| 10.14469/hpc/5031 | Haloamidines, NN cyclisation, TS -1184.969423 |
| 10.14469/hpc/5046 | Haloamidines, NN cyclisation , Na(H2O)5OH Cl migration/dissociation C-Cl TS -1729.171048 |
| 10.14469/hpc/5047 | Haloamidines, NN cyclisation , Na(H2O)5OH Cl migration/dissociation C-Cl TS -1729.170985 |
| 10.14469/hpc/5052 | Haloamidines, NN cyclisation , Na(H2O)5OH Cl ion-pair intermediate -1729.177153 |
| 10.14469/hpc/5056 | Haloamidines, NN cyclisation , Na(H2O)5OH Cl migration/dissociation C-Cl product -1729.214380 -26.9 |
| 10.14469/hpc/5057 | Haloamidines, NN cyclisation , Na(H2O)5OH Cl migration/dissociation C-Cl IRC |
| 10.14469/hpc/5126 | Haloamidines, NN cyclisation , SN2 displacement at N, -1729.172134 |
| 10.14469/hpc/5412 | Haloamidines, NN cyclisation , SN2 displacement at N IRC |
Associated DOIs
| Current dataset ... | DOI | Description |
|---|---|---|
| References | 10.1021/ja00947a040 | The Halogenation of Amidines. I. Synthesis of 3-Halo- and Other Negatively Substituted Diazirines |
| References | 10.1021/ja00947a041 | This article is included because the PDF contains the last page of the previous one. |