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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): 941 to 960 of 5986
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 27-Mar-2025 | cloransulam-methyl_CONF246_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66946426; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF25_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66928339; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF259_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67129681; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF264_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67133655; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF28_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66890570; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF281_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66971792; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF288_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66831967; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF29_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66882527; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF302_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67004641; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF303_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67044469; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF309_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66867934; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF31_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67183337; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF313_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67071077; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF314_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67001861; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF315_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67043471; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF325_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67107718; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF34_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67193505; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF35_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67179921; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF36_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.67274102; Eh | |||
 | 27-Mar-2025 | cloransulam-methyl_CONF38_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -2187.66928286; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 941 to 960 of 5986
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