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Re-examination of Steric Substituent Constants by Molecular Mechanics.

• Authors : Minoru Hirota; Kazuhisa Sakakibara; Tomoaki Yuzuri ...

Subjects: Steric effect; Steric hindrance; Molecular mechanics

• Source: http://www.mdpi.org/ijms/papers/i6010018.pdf.

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Dual Substituent Parameter Modeling of Theoretical, NMR and IR Spectral Data of 5-Substituted Indole-2,3-diones

• Authors : Ghazwan F. Fadhil; Hanan A. Radhy; Er Perjéssy ...

Subjects: 5-Substituted indole-2; 3-diones; AM1 and PM3 theoretical data

• Source: http://www.isuct.ru/khimia/molecules/papers/71100833.pdf.

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Substituent Effects in the 13 C-NMR Spectra of Six-Membered Nitrogen Heteroaromatic Compounds

• Authors : Janusz Oszczapowicz; The Pennsylvania State University CiteSeerX Archives

Subjects: 13 C-NMR; substituent polar effects; pyridines

• Source: http://www.mdpi.com/1422-0067/6/1/11/pdf/.

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Theoretical Study of Electronic Substituent Effect

• Authors : In Fluorine-containing Sydnones; The Pennsylvania State University CiteSeerX Archives

• Source: http://www.t-kougei.ac.jp/research/pdf/vol1-30-08.pdf.

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Original scientific paper A study of substituent effects on the NH bond in alkyl and aryl

• Authors : Slobodanka Jovanović; Dušan Mijin; Janos Csanadi ...

Subjects: substituted 2-pyridones; LFER analysis; NH bond

• Source: http://www.doiserbia.nb.rs/img/doi/0352-5139/2007/0352-51390712229M.pdf.

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Substituent Electronic Effects on the Mulliken Charges of N-(4-Substituted Benzylidene)-1-Phenylmethanamine Oxide Elucidated by DFT Calculations

• Authors : J. Sci Res; A. H. Essa; The Pennsylvania State University CiteSeerX Archives

Subjects: Correlation analysis; Hammett’s and Taft’s equations; Nitrone compounds

• Source: http://banglajol.info/index.php/JSR/article/download/3634/3920/.

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Ideal Ligand Substituent Prediction Using HINT for the Purpose of De Novo Ligand Design

• Authors : James A. Surface; Glen E. Kellogg; The Pennsylvania State University CiteSeerX Archives

• Source: http://ramsites.net/~jsurface/final_paper.pdf.

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Article Modes of Neighbouring Group Participation by the Methyl Selenyl Substituent in β-Methylselenylmethyl-substituted 1-Phenylethyl Carbenium Ions

• Authors : Benjamin L. Harris; Jonathan M. White; The Pennsylvania State University CiteSeerX Archives

Subjects: hyperconjugation; stereoelectronic effects; selenium interactions

• Source: http://www.mdpi.com/1420-3049/18/10/11705/pdf/.

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Chiral Peptide Nucleic Acids with a Substituent in the N-(2-Aminoethy)glycine Backbone

• Authors : Toru Sugiyama; Atsushi Kittaka; The Pennsylvania State University CiteSeerX Archives

Subjects: peptide nucleic acid; chiral; preorganization

• Source: http://www.mdpi.com/1420-3049/18/1/287/pdf/.

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[2+2]-Cyclocondensation of Acylbromides and Aldehydes: Investigation of Pyridinium Substituent Effects

• Authors : Patrick Meier; Florian Broghammer; Katja Latendorf ...

Subjects: aluminum; cooperative catalysis; ion pair catalysis

• Source: http://www.mdpi.com/1420-3049/17/6/7121/pdf/.

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