Results 191 to 200 of about 46,521 (243)

An Excellent Deep‐Ultraviolet Nonlinear Optical Crystal Realized via a Functional Group Based on a Two‐in‐One Strategy

open access: yesENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
A “two‐in‐one” design strategy integrating guanidinium and carboxyl functional groups was developed to overcome the intrinsic trade‐off among SHG response, ultraviolet cutoff edge, and birefringence in DUV NLO crystals. Benefiting from non‐π‐conjugated electronic isolation, Zn‐GPA(II) simultaneously achieves a strong SHG response (2.1 × KH2PO4), an ...
Xiliang Jiang   +8 more
wiley   +1 more source

Ligand Redox Noninnocence in Bis(phosphinimine) Diarylamido Pincer Complexes of Nickel

open access: yesEuropean Journal of Inorganic Chemistry, EarlyView.
The oxidative noninnocence of a bis(phosphinimine) ligand featuring a diarylamido backbone was investigated for several nickel complexes. Radical/charge delocalization across the aromatic backbone plays an important role in the stabilization of the diarylaminyl and putative diarylnitrenium complexes.
Xiujing Xing   +8 more
wiley   +1 more source

Synthesis of Zwitterionic Tris(pyrazolyl) Ligands and Their Mn(II) Bis‐Chelates Exhibiting Charge–Transfer‐Induced Spin Crossover

open access: yesEuropean Journal of Inorganic Chemistry, EarlyView.
In this article, a series of zwitterionic scorpionate ligands based on the anionic tris‐(pyrazolyl)borate ligand scaffold is presented. These ligands are used to prepare bis‐chelates with divalent manganese ions. The resulting complexes are studied via magnetic, crystallographic, and electrochemical means to characterize the charge–transfer‐induced ...
Matthew C. Kessinger   +5 more
wiley   +1 more source

lmp2gro: A Python Tool for Converting LAMMPS Data Files into GROMACS Topologies. [PDF]

open access: yesJ Chem Inf Model
Moni Pereira A   +3 more
europepmc   +1 more source

Resolution Approaches Toward Enantiopure Planar Chiral 7‐bromo‐4‐hydroxy [2.2]paracyclophane

open access: yesEuropean Journal of Organic Chemistry, EarlyView.
This work describes access to both enantiomers of planar chiral 7‐bromo‐4‐hydroxy [2.2]paracyclophane through direct resolution of the racemate using an L‐isoleucine‐derived chiral auxiliary or through resolution of 4‐hydroxy [2.2]paracyclophane, followed by regioselective bromination.
Arthur Le Coz   +5 more
wiley   +1 more source

Modular Synthesis of Di‐ and Triazadibenzoazulenes by a Cross‐Coupling/Cycloisomerization Strategy

open access: yesEuropean Journal of Organic Chemistry, EarlyView.
Two series of regioisomeric di‐ and triazadibenzoazulenes were prepared from dihalogenated imidazo[1,2‐a]pyridines and imidazo[1,2‐a]pyrazines. Imidazo[1,2‐a]pyridines and imidazo[1,2‐a]pyrazines are important nitrogen‐containing heterocycles with applications in medicinal and materials chemistry.
Karyna Kulyk   +6 more
wiley   +1 more source

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