| dc.contributor.author | Reihani, S. | en_US |
| dc.contributor.author | Azizi, Z. | en_US |
| dc.contributor.author | Khaleghian, M. | en_US |
| dc.contributor.author | Passdar, H. | en_US |
| dc.contributor.author | Pishkar, L. | en_US |
| dc.contributor.author | Ahmadi, R. | en_US |
| dc.contributor.author | Saedi, L. | en_US |
| dc.date.accessioned | 1399-07-09T01:40:04Z | fa_IR |
| dc.date.accessioned | 2020-09-30T01:40:04Z | |
| dc.date.available | 1399-07-09T01:40:04Z | fa_IR |
| dc.date.available | 2020-09-30T01:40:04Z | |
| dc.date.issued | 2007-08-01 | en_US |
| dc.date.issued | 1386-05-10 | fa_IR |
| dc.date.submitted | 2015-04-25 | en_US |
| dc.date.submitted | 1394-02-05 | fa_IR |
| dc.identifier.citation | Reihani, S., Azizi, Z., Khaleghian, M., Passdar, H., Pishkar, L., Ahmadi, R., Saedi, L.. (2007). Theoretical study of hydrogen bond effects on Diphenylphosphorylazide. Journal of Physical & Theoretical Chemistry, 4(2), 51-56. | en_US |
| dc.identifier.uri | http://jptc.srbiau.ac.ir/article_6593.html | |
| dc.identifier.uri | https://iranjournals.nlai.ir/handle/123456789/203762 | |
| dc.description.abstract | The interaction of DPPA which is an important component in cellular membrane with molecules of water as<br />media, cause some changes in geometry of DPPA .In this study we focused our attention on comparing this<br />molecule with related hydrated complexes employing different basis sets at hartree-fock levels of theory. The<br />theoretical NMR shielding tensor of some imported atoms were also reported. | en_US |
| dc.format.extent | 183 | |
| dc.format.mimetype | application/pdf | |
| dc.language | English | |
| dc.language.iso | en_US | |
| dc.publisher | Tehran, Islamic Azad University of Iran, Science and Research Branch | en_US |
| dc.relation.ispartof | Journal of Physical & Theoretical Chemistry | en_US |
| dc.subject | Hydrogen bond | en_US |
| dc.subject | DPPA | en_US |
| dc.subject | NMR shielding | en_US |
| dc.title | Theoretical study of hydrogen bond effects on Diphenylphosphorylazide | en_US |
| dc.type | Text | en_US |
| dc.type | Research Paper | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.contributor.department | - | en_US |
| dc.citation.volume | 4 | |
| dc.citation.issue | 2 | |
| dc.citation.spage | 51 | |
| dc.citation.epage | 56 | |
