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Please use this identifier to cite or link to this collection: DOI: 10.19061/iochem-bd-6-516

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Collection's Items (Sorted by Submit Date in Descending order): 1421 to 1440 of 5986
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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF84_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.08331955; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF92_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.08211785; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF93_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.08135305; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF12_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07865074; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF18_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07868237; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF28_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07833235; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF29_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07824273; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF36_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07772705; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF4_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07785888; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF41_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07771838; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF49_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07940343; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF50_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07896605; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF55_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07905051; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF58_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07724960; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF60_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07857541; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF67_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07829414; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF68_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07840110; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF69_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07773007; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF73_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07814944; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF91_waterPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.07854945; Eh
Collection's Items (Sorted by Submit Date in Descending order): 1421 to 1440 of 5986
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