Indian Association for the Cultivation of Science

About: Indian Association for the Cultivation of Science is a education organization based out in Kolkata, India. It is known for research contribution in the topics: Excited state & Catalysis. The organization has 3867 authors who have published 10457 publications receiving 220098 citations.

Molecular architecture using novel types of non-covalent π-interactions involving aromatic neutrals, aromatic cations and π-anions

Abstract: A solid-state complex utilizing non-covalent interactions between two aromatic cations is synthesized and characterized. The X-ray study of the structure shows that the anion templated π+–π+ interactions are the major driving force in the crystal packing, while π+–π, π–π, π–anion and π+–anion interactions assist the overall stabilization of self-assembly. In addition, we also identify the cation-mediated non-covalent interaction between two π anions (π−–π− interaction). The interaction energies of the important driving forces (π+–π+, π+–π, π–anion, π+–anion, and π−–π− interactions) observed in the crystal structure are calculated using dispersion-corrected density functional theory (DFT-D).

Highly fluorescent graphene oxide-poly(vinyl alcohol) hybrid: an effective material for specific Au3+ ion sensors.

Abstract: We have developed a new highly fluorescent graphene oxide (GO)/poly(vinyl alcohol) (PVA) hybrid (GO-PVA) in an acidic medium (pH 4). Fourier transform infrared (FTIR) spectra indicate the formation of hydrogen bonds between the hydroxy group of PVA and the hydroxy groups of GO. The hybrid is highly fluorescent, because of passivation by hydrogen bonding, as evident from Raman spectra. The quantum yields of GO-PVA hybrids are higher than that of GO. The fluorescent microscopic images of the hybrids exhibit a fibrillar morphology, and all of them emit highly intense green light. Field-emission scanning electron microscopy (FESEM) micrographs also show a fibrillar morphology, which is produced due to the supramolecular organization of GO-PVA complex. The highly fluorescent GO-PVA1 hybrid has been used as a fascinating tool for selective sensing of Au3+ ions in aqueous media with a detectable limit of ∼275 ppb. The sensitivity of the Au3+ ion (300 μM) in the presence of 600 μM concentrations of each ion (Cu2+...

A new functionalized mesoporous matrix supported Pd(II)-Schiff base complex: an efficient catalyst for the Suzuki–Miyaura coupling reaction

Abstract: A new Pd(II) bounded 2D-hexagonally ordered functionalized MCM-41 type material (IV) has been synthesized. Functionalization was carried out by the anchoring of 3-aminopropyltriethoxysilane in the MCM-41 type mesoporous material, followed by grafting with 2,6-diacetylpyridine (DAP) to give a N3-type Schiff base chelating attachment for the Pd(II) species. Fourier transform infrared (FTIR), powder X-ray diffraction (PXRD) and high resolution transmission electron microscopy (HRTEM) studies have been used to characterize the material. Material IV behaves as a highly active catalyst towards Suzuki–Miyaura cross-coupling reaction for the synthesis of biaryl organics. In addition, IV acts as a true heterogeneous catalyst in coupling reaction. It was found that this catalyst is highly efficient and recyclable towards Suzuki–Miyaura reaction with high turn over frequencies. X-Ray photoelectron spectroscopic (XPS) analysis was employed to understand the oxidation state of the palladium atom in the catalyst (IV) and its loading in the material.

A triazine functionalized porous organic polymer: excellent CO2 storage material and support for designing Pd nanocatalyst for C–C cross-coupling reactions

Abstract: One-pot bottom-up synthesis involving extended aromatic electrophilic substitution on to a pyrrole has been employed for the design of a novel triazine-functionalized porphyrin-based porous organic polymer, TPOP-1. Hydrothermal treatment of 4,4′,4′′-(1,3,5-triazine-2,4,6-triyl)tris(oxy)tribenzaldehyde and pyrrole in glacial acetic acid in the presence of FeCl3 leads to the formation of TPOP-1, which is a highly porous and robust material, and which exhibits a high surface area and bimodal pore sizes ranging from large micropores to mesopores. The presence of porphyrin and triazine functionality within the network structure enables formation of electron-donating basic N-sites at the surface of the porous organic framework and thus favors the adsorption of Lewis acidic CO2 molecules and decoration of the material by palladium nanoparticles at its surface to form Pd-TPOP-1. TPOP-1 showed good CO2 storage capacity (6.2 mmol g−1 or 27.3 wt% at 3 bar/273 K), suggesting its potential application in environmental clean-up. Moreover, this post Pd-functionalized material forms fine colloidal suspensions in organic solvent and exhibits high catalytic activity for Sonogashira cross-coupling of aryl halides with aryl alkynes under mild reaction conditions.

Electronic and Chemical Properties of Germanene: The Crucial Role of Buckling

Abstract: The heavier analogues of graphene, namely silicene and germanene, are known to be buckled. Such buckling leads to interesting properties like direct band gap in hydrogenated germanene, known as germanane. This article shows that the sequential replacement of C by Ge in benzene leads to increasing buckling with the maximal buckling distance (d = 0.61 A) in Ge6H6. The origin of such buckling induced lowering of symmetry (D6h → D3d) is traced to pseudo Jahn–Teller (PJT) distortion along the b2g normal mode arising out of mixing of the nondegenerate (A1g) ground state with low lying (Δ0 = 4.36 eV) excited state of B2g symmetry. Buckling also leads to enhanced chemical reactivity of germanene toward hydrogen to form germanane. The large affinity of germanene toward hydrogenation explains the experimental synthesis of exfoliated layers of germanane by Goldberger and co-workers [ACS Nano 2013, 7, 4414−4421]. Germanene → germanane formation leads to the opening up of a large band gap making hydrogenation a chemic...