<strong>Computational, Spectral & Single Crystal Studies of 4-chloro-N,Ndiphenylbenzamide</strong>
Online Publishing @ NISCAIR
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dc |
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Title Statement |
<strong>Computational, Spectral & Single Crystal Studies of 4-chloro-N,Ndiphenylbenzamide</strong> |
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Added Entry - Uncontrolled Name |
Shukla, Shraddha ; Department of Chemistry, Lucknow University, Lucknow 226007, India Bishnoi, Abha ; University Of Lucknow Devi, Poornima ; Department of Chemistry, Lucknow University, Lucknow 226007, India Fatma, Shaheen ; Department of Chemistry, Shri Ramswaroop Memorial University, Lucknow Dewa Road, Barabanki 225003, India Singh, Ramesh ; Indian Institute of Technology, Kanpur, India |
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Uncontrolled Index Term |
Spectroscopic; Structural; Parameters |
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Summary, etc. |
<p><span lang="EN-GB">The present work comprises of spectroscopic, crystal and <em>in silico </em>studies of 4-chloro-N,Ndiphenylbenzamide. Synthesis of the compound was done followed by respective characterization by different spectral approaches. The <em>in silico</em> studies of title compound was further performed to ascertain various structural and geometrical parameters. All the studies were carried out at thetheory level B3LYP functional and 6-31G (d, p) as basis set. The geometry and other structural aspects of 4-chloro-N,Ndiphenylbenzamide were confirmed by X-ray diffraction.</span></p> |
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Publication, Distribution, Etc. |
Indian Journal of Pure & Applied Physics (IJPAP) 2021-07-13 15:08:30 |
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Electronic Location and Access |
application/pdf http://op.niscair.res.in/index.php/IJPAP/article/view/27160 |
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Data Source Entry |
Indian Journal of Pure & Applied Physics (IJPAP); ##issue.vol## 59, ##issue.no## 7 (2021): Indian Journal of Pure & Applied Physics |
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Language Note |
en |
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Nonspecific Relationship Entry |
http://op.niscair.res.in/index.php/IJPAP/article/download/27160/465484033 http://op.niscair.res.in/index.php/IJPAP/article/download/27160/465484034 |
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Except where otherwise noted, the Articles on this site are licensed under Creative Commons License: CC Attribution-Noncommercial-No Derivative Works 2.5 India © 2015. The Council of Scientific & Industrial Research, New Delhi. |
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