The C-H···S-S hydrogen bonding in diethyl disulfide⋯difluoromethane: a combined microwave spectroscopic and computational study.

The C-H⋯S weak interaction is crucial for comprehending the stability in biological macromolecules and their interactions with smaller molecules. Despite its prevalence, an in-depth understanding and recognition of such interaction remain elusive. Herein, the rotational spectra of a binary complex formed by diethyl disulfide and difluoromethane were investigated using Fourier transform microwave spectroscopy combined with theoretical calculations to examine the C-H⋯S-S interaction.

The carbonyl-sulfur chalcogen bonding interaction: Rotational spectroscopic study of the 2,2,4,4-tetrafluoro-1,3-dithietane···formaldehyde complex.

The rotational spectrum of a binary molecular cluster consisting of 2,2,4,4-tetrafluoro-1,3-dithietane (CSF) and formaldehyde (HCO) was studied by means of high-resolution Fourier transform microwave spectroscopy in conjunction with quantum chemical calculations. One of the three isomers predicted at the B3LYP-D3(BJ)/def2-TZVP level of theory was successfully detected in the supersonic expansion. Theoretical analyses using the non-covalent interactions and natural bond orbital methods reveal that the observed isomer is primarily stabilized by one C=O⋯S chalcogen bond and two C-H⋯F hydrogen bonds.

Elucidating the non-covalent interactions in thiazole-carbon dioxide complexes through rotational spectroscopy and theoretical computations.

The complexes formed between thiazole and carbon dioxide were studied to probe the non-covalent bonding properties between carbon dioxide and a heteroaromatic ring. The rotational spectra of the thiazole-CO complex were analyzed using a supersonic jet Fourier transform microwave spectrometer in conjunction with theoretical calculations. A rotational spectrum corresponding to the global minimum of the thiazole-CO complex was identified.

Unveiling the Noncovalent Interactions between Formamide and Heteroaromatics: Microwave Spectroscopy of the Formamide Complexes with Furan and Thiophene.

The noncovalent interactions between formamide (FM) and the heteroaromatic compounds (furan and thiophene) were investigated through microwave spectroscopy and theoretical calculations. Each of the investigated complexes exhibits a single rotational spectrum corresponding to the lowest energy structure predicted theoretically. In the detected structures, N-H···O and C-H···O hydrogen bonds dominate the complexation between FM and furan, resulting in a planar configuration.

Unveiling the underappreciated: The bonding features of C-H⋯S-S interactions observed from rotational spectroscopy.

The C-H⋯S-S interactions are fundamentally important to understand the stability of biomacromolecules and their binding with small molecules, but they are still underappreciated. Herein, we characterized the C-H⋯S-S interactions in model molecular complexes. The rotational spectra of the complexes of diethyl disulfide with CH2CH2 and CH2CHF were measured and analyzed.

Hierarchical porous biochar from kelp: Insight into self-template effect and highly efficient removal of methylene blue from water.

Biochar is known to efficiently remove dyes especially for biochar with hierarchical pores and partial N-species. Here, a facile pyrolysis is used to yield N-doped biochar from kelp without additives, showing surface areas of 771 m/g as temperature up to 1000 °C and hierarchical small-sized mesopores (2-4 nm) and wide meso-macropores (8-60 nm). A possible self-template mechanism from inorganics is proposed to form hierarchical pore architecture in biochar and used for methylene blue (MB) removal.

Intermolecular amide and aldehyde interactions: rotational spectroscopy of the complexes of formaldehyde with 2-azetidinone and formamide.

The binary intermolecular complexes of amides and formaldehyde can be taken as suitable models to investigate the non-covalent interactions of a peptide with the carbonyl group. We herein studied the rotational spectra of the model complexes of 2-azetidinone-HCO and formamide-HCO generated in a helium supersonic jet. For each complex, one rotational spectra featuring hyperfine structures caused by the N quadrupole coupling effect was observed and assigned to its global minimum conformation.

Noncovalent Interactions between Aromatic Heterocycles and Carboxylic Acids: Rotational Spectroscopy of the Furan-Formic Acid and Thiophene-Formic Acid Complexes.

The binary molecular complexes formed between the aromatic heterocycles furan and thiophene with formic acid were investigated using pulsed-jet Fourier transform microwave spectroscopy and quantum chemical computations. For both of the complexes, rotational spectra of the lowest energy isomer were detected and assigned. Rotational spectroscopic results and density functional theory calculations support that the preferred conformation of the furan-formic acid complex is characterized by a relatively strong O-H···O and a weak C-H···O hydrogen bonds while the O-H···π and C-H···O hydrogen bonds stabilize the thiophene-formic acid complex.

CoSe hollow microspheres with superior oxidase-like activity for ultrasensitive colorimetric biosensing.

As one of the transition metal dichalcogenide, CoSe has received much attention because of its superior physicochemical properties. In this work, a self-templated approach was proposed for constructing CoSe hollow microspheres by utilizing ZIF-67 hollow sphere as a template. In the followed selenylation process, selenium vapor reacts with cobalt ion in ZIF-67 to form CoSe microspheres.

The transcription factor OsbHLH138 regulates thermosensitive genic male sterility in rice via activation of TMS5.

Thermosensitive genic male sterile (TGMS) lines favored heterosis exploitation in two-line hybrid rice. TMS5, a member of RNase Z cleavages the Ub mRNAs, plays an important role in two-line hybrid rice. Here, we identified a new TGMS mutant 93-11s, which lost two amino acids in the first exon of TMS5 gene and caused thermosensitive genic male sterility in rice.

QTL Mapping of Seed Vigor of Backcross Inbred Lines Derived From Under Artificial Aging.

Seed vigor is an important character of seed quality that promotes rice to germinate rapidly from soil and developing to a strong seedling, especially in the current rice direct-sowing production system. However, previous studies for seed vigor mainly concentrate in cultivars, and less reports involving in wild rice. In this study, 152 backcross inbred lines (BILs) derived from wild rice were genotyped with re-sequencing technology, and QTLs for seed vigor related traits under normal and artificial aging treatment were analyzed.

Artificial Selection of Gn1a Plays an Important role in Improving Rice Yields Across Different Ecological Regions.

Background: Rice is one of the most important crops, and it is essential to improve rice productivity to satisfy the future global food supply demands. Gn1a (OsCKX2), which encodes cytokinin oxidase/dehydrogenase, plays an important role in regulating rice grain yield.

Results: In this study, we analyzed the genetic variation of Gn1a, which influences grain yield through controlling the number of spikelets in rice.