13_herbicides
CC-BY-4.0
The original dataset source can be reviewed here
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-6-219
Please use this identifier to cite or link to this collection:doi:10.19061/iochem-bd-6-219
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | bixlozone_CONF1_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75332733; Eh | ||
 | bixlozone_CONF10_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75343670; Eh | ||
 | bixlozone_CONF11_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75336138; Eh | ||
 | bixlozone_CONF13_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75193297; Eh | ||
 | bixlozone_CONF14_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.74912971; Eh | ||
 | bixlozone_CONF16_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.74931360; Eh | ||
 | bixlozone_CONF17_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75269319; Eh | ||
 | bixlozone_CONF18_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75318793; Eh | ||
 | bixlozone_CONF19_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75291622; Eh | ||
 | bixlozone_CONF2_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75197206; Eh | ||
 | bixlozone_CONF20_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75170789; Eh | ||
 | bixlozone_CONF21_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75320789; Eh | ||
 | bixlozone_CONF22_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75326325; Eh | ||
 | bixlozone_CONF23_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75322191; Eh | ||
 | bixlozone_CONF24_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75289337; Eh | ||
 | bixlozone_CONF25_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75172344; Eh | ||
 | bixlozone_CONF26_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75106374; Eh | ||
 | bixlozone_CONF27_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75279116; Eh | ||
 | bixlozone_CONF28_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75279606; Eh | ||
 | bixlozone_CONF29_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1590.75169221; Eh |
Collection's Items (Sorted by in order): 1 to 20 of 241
