About
Database
| Aliases | gallanol gallium monohydroxide |
|---|---|
| Mass / amu | 86.73 |
| Sum formula | GaOH |
| InChI | InChI=1S/GaHO/c1-2/h2H |
| CAS | 32365-63-2 |
| PubChem | 6337722 |
| Structure |  |
| AIE / eV | 9.68 |
| VIE / eV | 9.68 |
| AIE comment | 10.1021/acs.jpca.5c02601 |
| VIE comment | 10.1021/acs.jpca.5c02601 |
| Citation | 10.1021/acs.jpca.5c02601 |
|---|---|
| Type | Mass-selected threshold photoelectron spectrum |
| Further references | 10.1063/1.4984304 10.1016/j.nima.2009.08.069 |
| T / K | 870 |
| Source | Pyrolysis |
| Resolution / meV | 5 |
| Flux normalization | no |
| Comments | Trimethylgallium diluted in argon and expanded through a SiC reactor. Mass resolution 200, field: 213 V/cm, i2PEPICO (CRF) setup |
| Date & facility | 2023 PSI SLS |
| Date entered | 2025-06-18 |
| Citation | 10.1021/acs.jpca.5c02601 |
|---|---|
| Type | Franck-Condon simulation |
| Further references | 10.1002/wcms.81 10.1002/wcms.1546 |
| T / K | 1000 |
| Level of theory | CCSD(T)/cc-pVTZ |
| Convolution FWHM / meV | 25 |
| 0-0 transition / eV | 9.68 |
| Comments | Simulation was made with EzSpectrum. Calculations were performed with Orca 5.0.3 |
| Date & facility | 2025 Universität Würzburg |
| Date entered | 2025-06-18 |