- -
1960 .
62
-
-
.., ..
BrᄷBr IᄷI ,
: ,
, , ,
, , -
.., ..,
..
-
.
: , ,
, ,
- , ,
Suvitha A., El-Mansy M.A.M.,
Kothandan G., Steephen A.
Molecular structure, FT-RAMAN, IR, NLO, NBO,
HOMO—LUMO analysis, physicochemical
descriptors, ADME parameters,
and pharmacokinetic bioactivity
of 2,3,5,6-tetrachloro-p-benzoquinone
Keywords: 2,3,5,6-tetrachloro-p-benzoquinone (TCBQ),
NBO, NLO, HOMO—LUMO, ADME, MEP, CADD
1436
1428
1421
- 12
9, 2021
2021
Стр.2
Ye W.-J., Chen D.-M., Wu Q.-M., Chen Y.-M.,
Yang D.-Z., Liao T.-H., Zhou Z.-X.
1454
Synthesis, crystal structure, and a DFT study
of tert-butyl-5-(4,4,5,5-tetramethyl-1,3,2dioxaborolan-2-yl)-1H-indazole-1-carboxylate
Keywords:
indazole, 4,4,5,5-tetramethyl-1,3,2dioxaborolan-2-yl,
synthesis, X-ray diffraction, DFT
.., .., ..
HCl–
: , HCl,
, ,
, ,
-
-
- .., .., ..,
.., .., ..,
..
{[Na2Co(pfb)2(H2O)8](pfb)2}n
: (II),
,
,
Li P., Li M., Li S.-Z., Wang J.-F., Dong W.-K.
Investigation on fluorescence property
and Hirshfeld surface analysis of a novel
heterobimetallic Cd(II)–Na(I) pyridine-terminal
salamo-type coordination polymer
Keywords: salamo-type pyridine terminal ligand,
synthesis, heterometallic coordination polymer,
Hirshfeld surface analysis, fluorescent material
Saini A., Gupta P., Bansal P., Sharma R.P., Krishan B.,
Kaur P., Ferretti V.
Syntheses, characterization, X-ray structural
determination, and packing analyses of ternary
copper(II) complexes:
[Cu(2-phenoxyacetate/4-chlorobenzoate)2(temed)]
Keywords: N,N,N,N-tetramethylenediamine,
2-phenoxyacetate, 4-chlorobenzoate, X-ray
1495
1482
1475
1461
Стр.3
- .., .., ..,
.., .., ..
1508
-(5--1,10-)
(II)
: , ,
5--1,10-, ,
..
[LRe(CO)3(O2CC3F7)]
: , ,
, , ,
.., ..,
.., ..
7--2,3,4a,6-[2,3-b][1,4]-6-
: ,
, ,
.., .., ..,
..
-
---[4]
: --[4],
, ,
-
.., .., ..,
.., .., ..
,
HW CVD
: , HW CVD,
,
.., .., ..,
.., .., ..
PtxIr(1–x),
: , ,
, ,
,
1546
1539
1529
1522
1513
Стр.4
-
Li W., Li C.-L.
A two-dimensional Co(II)-phosphonate framework:
Promotion activity on fractures via activating
the Wnt signaling pathway
Keywords: coordination complex, fracture,
molecular docking
Huang H., Li Y.-Y., Li H.-R.
Synthesis and anticancer activity against retinoblastoma
of novel Zn(II) and Co(II) complexes
Keywords: Schiff base ligand, coordination complexes,
cluster-based unit, retinoblastoma cancer
Ren Q., Huang P.-Y., Liu Y., Liao W.-K., Zhou Z.-X.,
Zhao C.-S.
Synthesis, crystal structure and DFT study
of 4-(2-chlorobenzyl)-1-(5-nitro-2-(pyrrolidin-1-yl)
phenyl)-[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Keywords: quinazolinone, synthesis, X-ray diffraction,
DFT, molecular docking, vibration analysis
—
1571
1563
1556
© , 2021
©
. .. , 2021
©
, 2021
Стр.5