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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 10-Sep-2022 | ethoxisulfuron_CONF1323_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38846872; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1323_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38846872; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1326_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38866406; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1326_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38866406; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1327_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38857366; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1327_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38857366; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1328_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38887123; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1328_water | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.38887123; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1329_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39170901; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1329_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39170901; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1330_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39175990; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1330_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39175990; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1331_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39217713; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1331_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39217713; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1332_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39069386; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1332_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39069386; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1333_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39091049; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1333_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39091049; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1334_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39143015; Eh | |||
 | 10-Sep-2022 | ethoxisulfuron_CONF1334_octanol | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | - | def2-TZVPP | -1726.39143015; Eh |