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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): 1381 to 1400 of 5986
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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF41_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05553540; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF44_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05581874; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF48_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05746946; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF5_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05892625; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF50_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05757465; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF54_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05754096; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF55_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05728002; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF6_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05966849; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF67_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05521901; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF71_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05577607; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF73_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05665207; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF77_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05569371; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF79_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05574864; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF8_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05969759; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF83_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05601515; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF85_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05558575; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF91_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05581689; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF93_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05723784; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF94_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05467058; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_p_CONF18_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.08270205; Eh
Collection's Items (Sorted by Submit Date in Descending order): 1381 to 1400 of 5986
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