Concepedia

Crystal structure, vibrational spectra and DFT simulations of 2-fluoro-4-bromobenzaldehyde

Mahir Tursun, Chandraju Sadolalu Chidan Kumar, Metin Bilge, Lydia Rhyman, Hoong‐Kun Fun, Cemal Parlak, Ponnadurai Ramasami, Siddegowda Chandraju, Ching Kheng Quah

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2015 · 13 citations · 26 references

DOI

Concepts

References

26

A short history of<i>SHELX</i>

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 87.4K citations · Full text

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Tables of bond lengths determined by X-ray and neutron diffraction. Part 1. Bond lengths in organic compounds

Frank H. Allen, Olga Kennard, Lee Brammer et al. · Journal of the Chemical Society Perkin Transactions 2 · 1987 · 8K citations

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An Evaluation of Harmonic Vibrational Frequency Scale Factors

Jeffrey Merrick, Damian Moran, Leo Radom · The Journal of Physical Chemistry A · 2007 · 2.7K citations

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Vibrational Energy Distribution Analysis (VEDA): Scopes and limitations

Michał H. Jamróz · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013 · 1.4K citations

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Predicting Molecules—More Realism, Please!

Roald Hoffmann, Paul von Ragué Schleyer, Henry F. Schaefer · Angewandte Chemie International Edition · 2008 · 339 citations

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