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DOI: 10.19061/iochem-bd-6-516
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Collection's Items (Sorted by Submit Date in Descending order): 1021 to 1040 of 5986
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Mar-2025 | cloransulam-methyl_CONF303_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70451828; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF309_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70185518; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF31_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70248427; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF313_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70364858; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF315_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70401974; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF33_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70211172; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF35_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70256349; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF39_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70249539; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF41_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70207987; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF43_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70269151; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF44_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70249386; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF45_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70262891; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF46_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70235866; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF54_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70265771; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF56_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70271505; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF57_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70279095; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF58_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70203930; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF6_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.69963304; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF67_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70270116; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF68_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -2187.70380482; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 1021 to 1040 of 5986
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