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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): 1301 to 1320 of 5986
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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF33_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05601534; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF37_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05587129; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF39_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05594727; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF4_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05852526; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF41_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05535906; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF44_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05608284; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF5_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05857732; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF50_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05595058; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF54_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05687731; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF56_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05664145; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF57_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05676824; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF60_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05692449; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF61_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05653325; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF7_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05569443; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF70_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05668141; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF75_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05493484; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF78_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05485391; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF79_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05488104; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF8_gasPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J-957.05930908; Eh
thumbnail.jpeg27-Mar-2025imazamethabenz-methyl_m_CONF10_octanolPulgar Rubio, AntonioOrca; 5.0.2; RELEASESingle pointDFTdef2-TZVPP; def2/J; cpcm-957.08168057; Eh
Collection's Items (Sorted by Submit Date in Descending order): 1301 to 1320 of 5986
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