FAIR data for (E)-6-((((E)-4-(4-methylphenyl)but-3-en-1-yl)oxy)methylene)cyclohexa-2,4-dien-1-one
DOI: 10.14469/hpc/4137 Metadata
Created: 2018-05-09 13:18
Last modified: 2018-05-23 19:50
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Co-author: Alan Spivey Co-author: Christian Nielsen
Description
Gaussian 16 calculations
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/3943 | FAIR Data: Reversibility and reactivity in an acid catalyzed cyclocondensation to give furanochromanes , a reaction at the oxonium-Prins vs. ortho-quinone methide cycloaddition mechanistic nexus |
Members
| DOI | Description |
|---|---|
| 10.14469/hpc/4144 | Racemate of (3aS,4S,9bR)-4-(p-tolyl)-2,3,3a,9b-tetrahydro-4H-furo[3,2-c]chromene |
| 10.14469/hpc/4145 | Racemate of (3aS,4S,9bS)-4-(p-tolyl)-2,3,3a,9b-tetrahydro-4H-furo[3,2-c]chromene |
| 10.14469/hpc/4150 | Crude E and Z alkene scrambling product |
Associated DOIs
| Current dataset ... | DOI | Description |
|---|---|---|
| References | 10.14469/hpc/4136 | HDA-2+4 mechanism, Product, cis + HCl, p=Me -1308.200591 |
| References | 10.14469/hpc/4138 | HDA-2+4 mechanism, Product trans + HCl, p=Me -1308.194331 |
| References | 10.14469/hpc/4147 | HDA-2+4 mechanism,TS1, cis + HCl, p=Me -1308.162846 |
| References | 10.14469/hpc/4152 | HDA-2+4 mechanism, TS1, trans + HCl, p=Me -1308.176539 |
| References | 10.14469/hpc/4153 | HDA-2+4 mechanism, Reactant, trans + HCl, p=Me -1308.192300 |
| References | 10.14469/hpc/4154 | HDA-2+4 mechanism, Reactant, p=Me -847.328552 |
| References | 10.14469/hpc/4161 | HDA-2+4 mechanism, TS, trans, p=Me -847.295935 |
| References | 10.14469/hpc/4163 | HDA-2+4 mechanism, TS2, trans + HCl, p=Me -1308.176306 |
| References | 10.14469/hpc/4169 | HDA-2+4 mechanism,TS1, cis + HCl, p=Me IRC |
| References | 10.14469/hpc/4173 | HDA-2+4 mechanism,TS2, cis + HCl, p=Me -1308.173687 |
| References | 10.14469/hpc/4180 | HDA-2+4 mechanism, TS1, trans + HCl, p=Me IRC |
| References | 10.14469/hpc/4258 | HDA-2+4 mechanism,TS2, cis + HCl, p=Me IRC 15 |
| References | 10.14469/hpc/4272 | HDA-2+4 mechanism,TS2, trans + HCl, p=Me IRC |
| References | 10.14469/hpc/4276 | HDA-2+4 mechanism,TS, trans, p=Me IRC |