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<strong>Computational, Spectral &amp; Single Crystal Studies of 4-chloro-N,Ndiphenylbenzamide</strong>

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Title Statement <strong>Computational, Spectral &amp; Single Crystal Studies of 4-chloro-N,Ndiphenylbenzamide</strong>
 
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
 
Uncontrolled Index Term Spectroscopic; Structural; Parameters
 
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>
 
Publication, Distribution, Etc. Indian Journal of Pure & Applied Physics (IJPAP)
2021-07-13 15:08:30
 
Electronic Location and Access application/pdf
http://op.niscair.res.in/index.php/IJPAP/article/view/27160
 
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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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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