Results 121 to 130 of about 4,190 (143)

Hirshfeld surface analysis of diclofenac acid

AIP Conference Proceedings, 2019
Deniz Baylan, Seda Gunesdogdu Sagdinc
openaire   +1 more source

Hirshfeld Surface Analysis for Investigation of Intermolecular Interaction of Molecular Crystals

International Journal of Organic Chemistry, 2023
Daisuke Nakane, Takashiro Akitsu
exaly  

Quantum Chemical, experimental spectroscopic, Hirshfeld surface and molecular docking studies of the anti-microbial drug Sulfathiazole

Journal of Molecular Structure, 2021
Aysha Fatima, Sandhya Savita, Indresh Verma   +2 more
exaly  

Crystal structure and Hirshfeld surface analysis of pinaverium bromide dihydrate

Powder Diffraction
In the present study, we have discovered and identified a new crystalline form of pinaverium bromide, pinaverium bromide dihydrate (C 26 H 41 BrNO 4 ⋅Br⋅2H 2 O), whose ...
Dezhen Chen, Wangting Zhou, Yujing Wei, Chenghan Zhuang, Yazheng He, Xiaoli Li, Kaibo Li, Zhaoxia Zhang, Guoqing Zhang   +8 more
openaire   +1 more source

Ambroxol: Insight into the Crystal Structure, Hirshfeld Surface Analysis and Computational Study

Polycyclic Aromatic Compounds, 2023
Larisa E Alkhimova, Maria G Babashkina, Damir A Safin   +2 more
exaly  

Computational, spectroscopic, Hirshfeld surface, electronic state and molecular docking studies on phthalic anhydride

Journal of Molecular Structure, 2022
Aysha Fatima, Ghazala Khanum, Km Garima   +2 more
exaly  

Crystal Structure, DFT Calculation, and Hirshfeld Surface Analysis of the 1-(Cyclohex-1-en-1-yl)-3-(prop-2-yn-1-yl)-1,3-dihydro-2H-benzimidazol-2-one

Crystals, 2023
Mohamed Adardour, Marouane Ait Lahcen, Ismail Hdoufane   +2 more
exaly  

Crystal structure and Hirshfeld surface analysis of dl-methionine polymorphs (α and β)

Journal of Molecular Structure, 2022
M Suresh, K Srinivasan
exaly  

Crystallographic investigation, Hirshfeld surface analysis, NLO characterization and experimental spectral (UV and NMR) studies with DFT probe on(R)-9-(2-hydroxy propyl)adenine

Heliyon, 2021
J Swaminathan
exaly  

Vibrational spectra, Hirshfeld surface analysis, molecular docking studies of (RS)-N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide by DFT approach

Heliyon, 2020
M Govindammal, M Prasath
exaly