Ultrasonic assisted synthesis of Zn(II) 2D coordination polymer and 4-nitroaniline photoluminescence sensing manifestation through DFT studies
Yazarlar (8)
Madiha Riasat
Government College University Lahore, Pakistan
Government College University Lahore, Pakistan
Shahzad Sharif
Government College University Lahore, Pakistan
Government College University Lahore, Pakistan
Shazia Khurshid
Government College University Lahore, Pakistan
Government College University Lahore, Pakistan
Sidra Farid
Government College University Lahore, Pakistan
Government College University Lahore, Pakistan
Rehana Bano
University Of The Punjab, Pakistan
University Of The Punjab, Pakistan
Mazhar Amjad Gilani
Comsats Institute Of Information Technology Lahore, Pakistan
Comsats Institute Of Information Technology Lahore, Pakistan
Prof. Dr. Onur ŞAHİN Sinop Üniversitesi, Türkiye
Fouzia Perveen
National University Of Sciences And Technology, Pakistan
National University Of Sciences And Technology, Pakistan
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Journal of Coordination Chemistry (Q3) | ||
| Dergi ISSN | 0095-8972 Dergi Bilgileri (2022) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 02-2022 |
| Kabul Tarihi | 15-02-2022 | Yayınlanma Tarihi | 16-02-2022 |
| Cilt / Sayı / Sayfa | 75 / 3 / 431–447 | DOI | 10.1080/00958972.2022.2046268 |
| Makale Linki | http://dx.doi.org/10.1080/00958972.2022.2046268 | ||
| UAK Araştırma Alanları |
Yoğun Madde Fiziği
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| Özet |
| Zinc(II) 2 D polymer, [Zn(3,5-Pydc)0.5·H2O]n (1) {3,5-Pydc = pyridine-3,5-dicarboxylate anion}, has been prepared under sonication conditions. The natural bond orbital (NBO) analysis revealed that charge transfer transitions in the vicinity of Zn(II) is accompanied with the highest stabilization energy of 140.13 kcal/mol. Furthermore, molecular electrostatic potential (MEP) analysis has been carried out to identify the reactive sites over the surface of the complex. 1 was characterized by elemental analysis, FTIR spectroscopy, thermal analysis and single crystal X-ray diffraction. The metal-based luminescence properties revealed that 1 can be used as selective chemosensor against 4-nitroaniline. Complex 1 showed excellent quenching efficiency of 98.9% with KSV value of 3.7 × 105 M−1. Density functional theory simulations complement to the specific luminescence quenching of 1 against 4-nitroaniline. |
| Anahtar Kelimeler |
| DFT studies | photoluminescence quenching | Ultrasonic | zinc 2D polymer |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 1 |
| Scopus | 1 |
| Google Scholar | 2 |