{"product_id":"structural-stability-and-vibrational-spectra-of-some-organoazides-von-khalid-al-ghamdi","title":"STRUCTURAL STABILITY AND VIBRATIONAL SPECTRA OF SOME ORGANOAZIDES","description":"\u003cp\u003eNowadays, simulation methods changed chemistry from  being a purely empirical science to be semi  empirical science.  Azides compounds are  characterized as highly unstable compounds with an  explosive nature so for sure exploring their  physical properties through an experimental work is  a risky job and now we can appreciate the  importance  of computational chemistry as a vital tool in  helping chemists to reach to their destinations  with  minimum losses (time, chemicals and personal  safety). This book therefore, represents a typical  systematic approach to any new comer to the field  of  computational chemistry.  This book starts with a  very simplified approach for explaining the  fundamental concepts of Quantum Chemistry, followed  by studying the azides compounds;  halocarbonylazides, halovinylazides,  dihalovinylazides, nitrosoazide, nitroazide and  halosulfonylazidies. The ab initio calculations by  the extended basis set 6-311++G** extended basis  set  at the DFT-B3LPY was utilized into this study.\u003c\/p\u003e\u003cdiv class=\"aw-variant-hidden-subtitle-div\" id=\"aw-variant-subtitle-9783838339511\"\u003e\u003ch3\u003eComputational Approach for Determining Structural Stability for Some of Halogenated Azides  Compounds\u003c\/h3\u003e\u003c\/div\u003e","brand":"Autorenwelt Shop","offers":[{"title":"Softcover - 9783838339511","offer_id":39499069489245,"sku":"9783838339511","price":68.0,"currency_code":"EUR","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0940\/0622\/files\/782526f9-ad71-4573-a328-5b56342311a8.jpg?v=1759211543","url":"https:\/\/shop.autorenwelt.de\/products\/structural-stability-and-vibrational-spectra-of-some-organoazides-von-khalid-al-ghamdi","provider":"Autorenwelt Shop","version":"1.0","type":"link"}