Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | ipflufenoquin_CONF13_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51948987; Eh | ||
 | ipflufenoquin_CONF14_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51993603; Eh | ||
 | ipflufenoquin_CONF16_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51938635; Eh | ||
 | ipflufenoquin_CONF17_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51966908; Eh | ||
 | ipflufenoquin_CONF18_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51953980; Eh | ||
 | ipflufenoquin_CONF19_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51828985; Eh | ||
 | ipflufenoquin_CONF2_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51987868; Eh | ||
 | ipflufenoquin_CONF20_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51804294; Eh | ||
 | ipflufenoquin_CONF21_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51824297; Eh | ||
 | ipflufenoquin_CONF24_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51919694; Eh | ||
 | ipflufenoquin_CONF25_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51829369; Eh | ||
 | ipflufenoquin_CONF29_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51713996; Eh | ||
 | ipflufenoquin_CONF3_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51872238; Eh | ||
 | ipflufenoquin_CONF30_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51904667; Eh | ||
 | ipflufenoquin_CONF31_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51906399; Eh | ||
 | ipflufenoquin_CONF32_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51894728; Eh | ||
 | ipflufenoquin_CONF33_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51890846; Eh | ||
 | ipflufenoquin_CONF34_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51892115; Eh | ||
 | ipflufenoquin_CONF35_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51865552; Eh | ||
 | ipflufenoquin_CONF36_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51887941; Eh | ||
 | ipflufenoquin_CONF37_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51805550; Eh | ||
 | ipflufenoquin_CONF38_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51802432; Eh | ||
 | ipflufenoquin_CONF39_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51801929; Eh | ||
 | ipflufenoquin_CONF4_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51873683; Eh | ||
 | ipflufenoquin_CONF40_octanol | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | - | def2-TZVPP | -1238.51885066; Eh |
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