Abstract
C49H52Cl2N10O6, monoclinic, P21 (no. 4), a = 12.2875(14) Å, b = 8.3031(10) Å, c = 13.1242(15) Å, β =
The molecular structure is shown in the figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.

Data collection and handling.
Crystal: | Colourless block |
Size: | 0.28 × 0.26 × 0.20 mm |
Wavelength: | Mo Kα radiation (0.71073 Å) |
μ: | 0.18 mm−1 |
Diffractometer, scan mode: | φ and ω |
θ max, completeness: | 27.7°, 99% |
N(hkl)measured, N(hkl)unique, R int: | 10,614, 5454, 0.016 |
Criterion for I obs, N(hkl)gt: | I obs > 2σ(I obs), 4318 |
N(param)refined: | 344 |
Programs: | Bruker [1], SHELX [2, 3], Diamond [4] |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).
Atom | x | y | z | U iso*/U eq |
---|---|---|---|---|
O1 | 0.6809 (4) | 1.0687 (5) | 0.9217 (3) | 0.0711 (13) |
O2 | 0.7512 (4) | 0.7216 (5) | 1.0509 (3) | 0.0749 (13) |
O3 | 0.8512 (4) | 0.9645 (7) | 0.8134 (3) | 0.0857 (15) |
N1 | 0.5765 (4) | 0.7728 (5) | 0.8016 (3) | 0.0453 (10) |
N2 | 0.5600 (4) | 0.8424 (5) | 0.6239 (3) | 0.0495 (11) |
N3 | 0.4907 (4) | 0.4149 (5) | 0.6637 (3) | 0.0549 (12) |
N4 | 0.5318 (4) | 0.4931 (6) | 0.8342 (3) | 0.0560 (12) |
N5 | 0.5039 (5) | 0.6628 (5) | 0.4913 (3) | 0.0592 (13) |
H5A | 0.5087 | 0.7397 | 0.4485 | 0.071* |
H5B | 0.4835 | 0.5684 | 0.4687 | 0.071* |
C1 | 0.5831 (6) | 0.9853 (7) | 0.9355 (4) | 0.0638 (16) |
H1A | 0.5194 | 1.0259 | 0.8883 | 0.077* |
H1B | 0.5700 | 0.9972 | 1.0059 | 0.077* |
C2 | 0.6048 (5) | 0.8112 (6) | 0.9122 (4) | 0.0486 (13) |
H2 | 0.5635 | 0.7408 | 0.9516 | 0.058* |
C3 | 0.7303 (5) | 0.7942 (7) | 0.9535 (4) | 0.0591 (15) |
H3 | 0.7670 | 0.7358 | 0.9041 | 0.071* |
C4 | 0.7709 (6) | 0.9690 (8) | 0.9659 (4) | 0.0691 (18) |
H4 | 0.7889 | 0.9930 | 1.0400 | 0.083* |
C5 | 0.5830 (5) | 0.8755 (7) | 0.7241 (4) | 0.0515 (13) |
H5 | 0.6058 | 0.9799 | 0.7423 | 0.062* |
C6 | 0.5279 (4) | 0.6897 (6) | 0.5924 (3) | 0.0432 (11) |
C7 | 0.5210 (5) | 0.5737 (6) | 0.6687 (4) | 0.0437 (12) |
C8 | 0.5453 (4) | 0.6159 (6) | 0.7724 (4) | 0.0430 (12) |
C9 | 0.4993 (6) | 0.3761 (7) | 0.7631 (4) | 0.0624 (17) |
H9 | 0.4835 | 0.2725 | 0.7832 | 0.075* |
C10 | 0.7479 (7) | 0.5497(8) | 1.0464 (5) | 0.078 (2) |
H10A | 0.8154 | 0.5099 | 1.0267 | 0.094* |
H10B | 0.6864 | 0.5159 | 0.9940 | 0.094* |
C11 | 0.7353 (5) | 0.4788 (8) | 1.1488 (4) | 0.0621 (15) |
C12 | 0.7300 (7) | 0.3123 (8) | 1.1589 (6) | 0.080 (2) |
H12 | 0.7342 | 0.2473 | 1.1020 | 0.096* |
C13 | 0.7186 (7) | 0.2424 (11) | 1.2509 (7) | 0.094 (2) |
H13 | 0.7165 | 0.1308 | 1.2566 | 0.112* |
C14 | 0.7102 (6) | 0.3392 (11) | 1.3363 (6) | 0.089 (2) |
H14 | 0.7023 | 0.2931 | 1.3992 | 0.107* |
C15 | 0.7137 (7) | 0.5019 (12) | 1.3259 (6) | 0.089 (2) |
H15 | 0.7061 | 0.5674 | 1.3817 | 0.107* |
C16 | 0.7282 (6) | 0.5710 (9) | 1.2344 (5) | 0.0729 (19) |
H16 | 0.7334 | 0.6824 | 1.2302 | 0.088* |
C17 | 0.8686 (7) | 1.0129 (11) | 0.9179 (5) | 0.094 (3) |
H17A | 0.8802 | 1.1285 | 0.9223 | 0.113* |
H17B | 0.9343 | 0.9607 | 0.9552 | 0.113* |
C18 | 0.9365 (7) | 1.0161 (12) | 0.7630 (6) | 0.103 (3) |
H18A | 1.0063 | 0.9716 | 0.7974 | 0.124* |
H18B | 0.9419 | 1.1326 | 0.7660 | 0.124* |
C19 | 0.9136 (6) | 0.9617 (10) | 0.6510 (6) | 0.082 (2) |
C20 | 0.8159 (7) | 0.9856 (11) | 0.5894 (7) | 0.091 (2) |
H20 | 0.7604 | 1.0406 | 0.6147 | 0.109* |
C21 | 0.7963 (7) | 0.9279 (13) | 0.4859 (7) | 0.103 (3) |
H21 | 0.7274 | 0.9398 | 0.4440 | 0.123* |
C22 | 0.8845 (11) | 0.8519 (15) | 0.4485 (8) | 0.131 (4) |
H22 | 0.8742 | 0.8156 | 0.3804 | 0.158* |
C23 | 0.9865 (10) | 0.8309 (14) | 0.5123 (10) | 0.126 (4) |
H23 | 1.0455 | 0.7829 | 0.4882 | 0.152* |
C24 | 0.9962 (7) | 0.8847 (14) | 0.6133 (8) | 0.117 (3) |
H24 | 1.0628 | 0.8673 | 0.6580 | 0.141* |
C25a | 0.8801 (13) | 0.5516 (19) | 0.7106 (13) | 0.118 (11) |
H25Aa | 0.8501 | 0.6581 | 0.7185 | 0.141* |
H25Ba | 0.9055 | 0.5495 | 0.6446 | 0.141* |
Cl1a | 0.9913 (10) | 0.5234 (13) | 0.8067 (7) | 0.137 (4) |
Cl2a | 0.7787 (6) | 0.4180 (14) | 0.7065 (16) | 0.178 (8) |
C25b’ | 0.807 (2) | 0.437 (5) | 0.7672 (14) | 0.035 (9) |
H25Cb | 0.8028 | 0.3329 | 0.8004 | 0.042* |
H25Db | 0.7521 | 0.5071 | 0.7887 | 0.042* |
Cl1′b | 0.9374 (13) | 0.5180 (19) | 0.8048 (14) | 0.081 (6) |
Cl2′b | 0.780 (2) | 0.414 (3) | 0.6367 (11) | 0.094 (7) |
-
aOccupancy: 0.362(10), boccupancy: 0.138(10).
1 Source of materials
An improved synthesis was performed which was similar to the previous report [5]. To the solution of 3, 5-O-dibenzyl-2-methylsulfonyl-1-deoxy-d-ribose (5.00 g, 12.7 mmol) in anhydrous dimethylformamide (100 mL) was added adenine (3.44 g, 25.5 mmol), K2CO3 (3.52 g, 25.5 mmol) and 18-crown 6-ether (13.47 g, 51.0 mmol) under an argon atmosphere. After addition, the reaction mixture was heated at 110 °C for 10 h. TLC detection showed the reaction was finished. After filtration, the solvent was removed in vacuo. The obtained residue was dissolved in dichloromethane (100 mL), washed with water (50 mL × 2), brine (50 mL × 2), and dried over anhydrous MgSO4. After filtration, the solvent was evaporated in vacuo. The obtained residue was purified by column chromatography to afford white solid of N 9-isoadenosine (4.67 g, 85%) and the title compound N 3-isoadenosine (0.39 g, 7%), which was further purified by recrystallization from dichloromethane and methanol. Crystals were obtained by slow evaporation from the solution at 268–270 K.
2 Experimental details
Restrained distances: C25–Cl1 = C25–Cl2 = C25′–Cl1′ = C25′–Cl2′; U iso/U aniso restraints and constraints: U anis(C25′)1.2U eq: with sigma of 0.01 and sigma for terminal atoms of 0.02; Secondary CH2 refined with riding coordinates: C1(H1A, H1B), C10(H10A, H10B), C17(H17A, H17B), C18(H18A, H18B), C25(H25A, H25B), C25′ (H25C, H25D); Aromatic/amide H refined with riding coordinates: C5(H5), C9(H9), C12(H12),
3 Comment
Isonucleoside (iso-NA) is a nucleoside isomer, in which the nucleobase is moved from C-1 to other positions of ribose, that showed effective activity against a broad spectrum of viruses and good resistance to enzyme hydrolysis [6], [7], [8]. Moreover, Antisense oligonucleotides (ASONs) and siRNA modified with isonucleoside showed promising therapeutic potential and gene silencing activities [9–10]. It is significant to construct new isonucleoside derivatives for drug candidate [11], [12], [13]. In this paper, 1′-deoxy-2′-d-isonucleosides were synthesized by combining 3,5-O-dibenzyl-2-methylsulfonyl-1-deoxy-d-ribose with adenine by nucleophilic substitution. After the reaction, three isomers, N
9, N
7 and N
3, were obtained with yield of N
9 (85%), N
7 (3%) and N
3 (7%), respectively. In the literature, detailed analysis of all three isomers was not reported before and their NMR spectrum are very similar. Fortunately, the crystal structures of N
3-isoadenosine (3-(1′-deoxy-3′,5′-O-dibenzy-β-d-ribosyl)adenine) was obtained by continuous adjustment of crystallization conditions. It is very helpful for determination of the exact structures of all three isomers. In the meantime, it is very significant for further understanding their interaction with reverse transcriptase. The title structure (see the Figure) contains one isoadenosine and one irregular dichloromethane solvent molecule. The isoadenosine consists of a benzyl-protected 1-deoxyribose and an adenine fragment by a C2–N1 bonding at 1.467(6) Å, where the glycosidic bond is an axial direction on the C2-position of furanose ring with torsion angle of
Acknowledgements
This work was supported by the Jiangxi Provincial Natural Science Foundation (20224BAB203006), the Education Department of Jiangxi Province (No. GJJ2201315), and the Open Foundation (No. 2022KFJJ003) of Jiangxi Science & Technology Normal University.
-
Author contributions: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.
-
Research funding: Jiangxi Provincial Natural Science Foundation (20224BAB203006), the Education Department of Jiangxi Province (No. GJJ2201315), and the Open Foundation (No. 2022KFJJ003) of Jiangxi Science & Technology Normal University.
-
Conflict of interest statement: The authors declare no conflicts of interest regarding this article
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© 2023 the author(s), published by De Gruyter, Berlin/Boston
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Artikel in diesem Heft
- Frontmatter
- New Crystal Structures
- Crystal structure of a polymorph of potassium picrate, C6H2KN3O7
- The crystal structure of (1E,2E)-1,2-bis(quinolin-2-ylmethylene)hydrazine, C20H14N4
- 5-Amino-2-chloro-4-fluoro-N-(N-isopropyl-N-methylsulfamoyl) benzamide, C11H15O3ClFN3S
- Crystal structure of trans-N 1,N 8-bis(2-cyanoethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane, C22H42N6
- The crystal structure of [N-{[2-(oxy)-4-methoxyphenyl](phenyl)methylidene}alaninato]-diphenyl-silicon(IV) – chloroform (1/1), C29H25NO4Si·CHCl3
- Crystal structure of tetracarbonyl-{μ-[N-(diphenylphosphanyl)-N,P,P-triphenylphosphinous amide]}-bis[μ-(phenylmethanethiolato)]diiron (Fe–Fe), C48H39Fe2NO4P2S2
- Crystal structure of baryte from Mine du Pradet (France)
- The crystal structure of [(2,2′-bipyridine-6-carboxylato-κ3 N,N,O)-(6-phenylpyridine-2-carboxylate-κ2 N,O)copper(II)] monohydrate, C23H17N3O5Cu
- Crystal structure of bis(μ-benzeneselenolato)-(μ-[N-benzyl-N-(diphenylphosphanyl)-P,P-diphenylphosphinous amide])-tetracarbonyl diiron (Fe–Fe), C47H37Fe2NO4P2Se2
- The crystal structure of diaqua-methanol-κ1 O- (3-thiophenecarboxylato-κO)-(2,2′-dipyridyl-κ2 N,N′)manganese(II) 3-thiophenecarboxylate, C21H22N2O7S2Mn
- Crystal structure of catena-poly[tetrakis(butyl)-μ2-2-((oxido(phenyl)methylene)hydrazineylidene)propanoato-κ4 O:O,O′,N-μ2-2-((oxido(phenyl)methylene)hydrazineylidene)propanoato-κ4 O,N,O′:N′-ditin(IV)], C34H50N6O6Sn2
- Crystal structure of 4-chloro-N′-[(1E)-(2-nitrophenyl)methylidene]benzohydrazide, C14H10ClN3O3
- The crystal structure of 3-(1′-deoxy-3′,5′-O-dibenzy-β-d-ribosyl)adenine dichloromethane solvate, C49H52Cl2N10O6
- The crystal structure of (Z)-4-amino-N′-(1-(o-tolyl)ethylidene)benzohydrazide, C16H17N3O
- The co-crystal structure of etoricoxib–phthalic acid (1/1), C18H15ClN2O2S·C8H6O4
- Crystal structure of (glycinto-κ 2 O,N ′)-[5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ 4 N,N ′,N ″,N ‴]nickel(II) perchlorate monohydrate C18H42ClN5NiO7
- The crystal structure of catena-poly[bis(1-ethylimidazole-k1 N)-(μ 2-benzene-1-carboxyl-3,5-dicarboxylato-κ 2 O, O′)zinc(II)], C19H20N4O6Zn
- Crystal structure of 3-(thiazol-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, C11H12N2O4S
- Rietveld structure analysis of keatite, a rare, metastable SiO2 polymorph
- Crystal structure of catena-poly[(μ2-isophthalato-k3 O,O′:O″)(4-(4-pyridyl)-2,5-dipyrazylpyridine-k3 N,N′,N″)cobalt(II)] trihydrate C26H22N6O7Co1
- Crystal structure of 3,5–di-O-benzoyl-1,2-O-isopropylidene-α–D-ribose, C22H22O7
- The crystal structure of fac-tricarbonyl(6-bromo-2,2-bipyridine-κ2 N,N)-(nitrato-κO)rhenium(I), C13H7BrN3O6Re
- The crystal structure of (E)-N′-(4-hydroxy-3-methoxybenzylidene)-2-naphthohydrazide monohydrate, C19H18N2O4
- The crystal structure of 5,5′-diselanediyl-bis(2-hydroxybenzaldehyde), C14H10O4Se2
- The crystal structure of catena-poly[diaqua-m2-dicyanido-κ2 C:N-dicyanido-κ1 C-bis(4-(pyridin-4-yl)benzaldehyde-κ1N)iron(II)-platinum(II), C28H22N6O4PtFe
- Redetermination of the crystal structure of 5,14-dihydro-6,17-dimethyl-8,15-diphenyldibenzo(b,i)(1,4,8,11)tetra-azacyclotetradecine, C32H28N4
- Crystal structure of poly[(μ3-2-(3,5-dicarboxyphenyl) benzimidazole-6-carboxylato-κ4O:O:O′:O″)lead(II)] monohydrate, C16H10N2O7Pb
- The crystal structure of fac-tricarbonyl(2-pyridin-2-yl-quinoline-κ2 N,N′)-(pyrazole-κN)rhenium(I)nitrate, C20H14N4O3ReNO3
- Crystal structure of dibromo-dicarbonyl-bis(tricyclohexylphosphine)-osmium(II) dichloromethane solvate, C38H66Br2O2OsP2
- Crystal structure of poly[bis(μ 2-2,6-bis(1-imidazoly)pyridine-κ 2 N:N′)copper(II)] diperchlorate dihydrate, C22H22Cl2CuN10O10
- The crystal structure of fac-tricarbonyl(N-benzoyl-N,N-cyclohexylmethylcarbamimidothioato-κ2 S,O)-(pyridine-κN)rhenium(I), C23H24N3O4ReS
- Crystal structure of (E)-7-fluoro-2-(4-fluorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one, C17H12F2O
- Synthesis and crystal structure of 1-((3R,10S,13S, 17S)-3-((2-methoxyphenyl)amino)-10,13-dimethylhexadecahydro-1H-cyclopenta[α]phenanthren-17-yl)ethan-1-one, C28H41NO2
- The crystal structure of fac-tricarbonyl((pyridin-2-yl)methanamino-κ2 N,N′)-((pyridin-2-yl)methanamino-κN)rhenium(I) nitrate, C15H16O3N4Re
- The crystal structure of (1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)-N-((1-(4-vinylbenzyl)-1H-benzo[d]imidazol-2-yl)methyl)methanamine-κ 4 N,N′,N″,N‴)tris(nitrato-kO,O′)-erbium(III), C29H27ErN8O9
- Crystal structure of tetracene-5,12-dione, C18H10O2
- Crystal structure of (3R,3aS,6R,6aR)-6-hexyl-3-methyltetrahydrofuro[3,4-b]furan-2,4-dione, C13H20O4
- The crystal structure of N′1,N′3-bis((E)-thiophen-2-ylmethylene)isophthalohydrazide monohydrate, C18H16N4O3S2
- Crystal structure of methyl ((4-aminobenzyl)sulfonyl)-L-prolinate, C13H18N2O4S
- Crystal structure of (E)-3-(3-methoxybenzylidene)benzofuran-2(3H)-one, C16H12O3
- Synthesis and crystal structure (E)-1-(4-bromo-2-hydroxyphenyl)-3-(dimethylamino)prop-2-en-1-one, C11H12BrNO2
- Synthesis and crystal structure of (S,E)-4-hydroxy-3-(2-((4aR,6aS,7R,10aS,10bR)-3,3,6a,10b-tetramethyl-8-methylenedecahydro-1H-naphtho[2,1-d][1,3]dioxin-7-yl)ethylidene)dihydrofuran-2(3H)-one, C23H34O5
- The crystal structure of N,N′-(1,2-phenylene)bis (2-((2-oxopropyl)selanyl)benzamide), C26H24N2O4Se2
- The crystal structure of 1-ethyl-2-nitro-imidazole oxide, C5H7N3O3
- The crystal structure of 2-(2-fluorophenyl)naphtho[2,1-d]thiazole, C17H10FNS
- Crystal structure of (E)-2,4-di-tert-butyl-6-(((2-fluorophenyl)imino) methyl)phenol, C21H26FNO
- Synthesis and crystal structure of 3-methyl-2-(methylthio)-4H-chromen-4-one, C12H12O2S
- Crystal structure of dithieno[2,3-d:2′,3′-d′]benzo[1,2-b:4,5-b′]dithiophene-5,10-dione, C14H4O2S4
- The crystal structure of dimethyl 2,2ʹ-((adamantane-1,3-diylbis(4,1-phenylene)) bis(oxy))diacetate, C28H32O6
- The crystal structure of N-(6-chloro-2-methyl-2H-indazol-5-yl)acetamide, C10H10ClN3O
- Crystal structure of triaqua-(5-bromoisophthalato-κ1 O)-(2,2′-bipyridine-κ2 N:N′)nickel(II) hydrate, C18H19BrN2NiO8
- The crystal structure of 2-amino-4-carboxypyridin-1-ium perchlorate, C6H7ClN2O6
- The crystal structure of catena-poly[5-aminonicotinic acid-k1 N-m2-bromido-copper(I)], Cu(C6N2H6O2)Br
- The crystal structure of 2,2-bis(3-methoxyphenyl)-1-tosyl-1,2-dihydro- 2λ4,3λ4 -[1,3,2]diazaborolo[4,5,1-ij]quinoline - dichloromethane (1/1)
- The crystal structure of catena-poly[bis(6-phenylpyridine-2-carboxylato-κ2 N,O)-(μ2-4,4′-bipyridne-κ2 N:N)cadmium(II)], C34H24N4O4Cd
- The crystal structure of 5,7-dinitropyrazolo[5,1-b]quinazolin-9(4H)-one, C10H5N5O5
- Crystal structure of rac-1,8-bis(2-carbamoylethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane, C22H46N6O2
- The crystal structure of (E)-N ′-(2-bromobenzylidene)-2-naphthohydrazide, C36H26Br2N4O2
- The crystal structure of 5-nitronaphthoquinone, C10H5NO4
- The crystal structure of (S, R p )-4–benzhydrylideneamino-12-(4-tert-butyl oxazolin-2-yl)[2.2]paracyclophane, C36H36N2O
- Synthesis and crystal structure of 2-(2-oxo-2-(o-tolyl)ethyl)-4H-chromen-4-one, C18H14O3
- Crystal structure of 2-(thiazol-2-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, C11H10N2O3S
- Crystal structure of N-(diaminomethylene)-1-(dimethylamino)-1-iminiomethanaminium dichloride, C4H13Cl2N5
- Crystal structure of poly[(μ3-3, 5-dichloro-2-hydroxy-benzoato-κ4 Cl,O:O′:O″) silver(I)], C7H3AgCl2O3
- The crystal structure of tetrakis(1-isopropylimidazole-κ1 N)-[μ2- imidazole-4,5-dicarboxylato-κ4 O,N,O′,N′)]- trioxido-divanadium, C29H41N10O7V2
- Crystal structure of catena-[(μ3-bromido)-(1H-1,2,4-triazol-1-yl)benzoato-κ1 N)copper(I)], C9H7BrCuN3O2
- The crystal structure of (E)-4-fluoro-N′-(1-(2-hydroxyphenyl)propylidene)benzohydrazide, C16H15FN2O2
Artikel in diesem Heft
- Frontmatter
- New Crystal Structures
- Crystal structure of a polymorph of potassium picrate, C6H2KN3O7
- The crystal structure of (1E,2E)-1,2-bis(quinolin-2-ylmethylene)hydrazine, C20H14N4
- 5-Amino-2-chloro-4-fluoro-N-(N-isopropyl-N-methylsulfamoyl) benzamide, C11H15O3ClFN3S
- Crystal structure of trans-N 1,N 8-bis(2-cyanoethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane, C22H42N6
- The crystal structure of [N-{[2-(oxy)-4-methoxyphenyl](phenyl)methylidene}alaninato]-diphenyl-silicon(IV) – chloroform (1/1), C29H25NO4Si·CHCl3
- Crystal structure of tetracarbonyl-{μ-[N-(diphenylphosphanyl)-N,P,P-triphenylphosphinous amide]}-bis[μ-(phenylmethanethiolato)]diiron (Fe–Fe), C48H39Fe2NO4P2S2
- Crystal structure of baryte from Mine du Pradet (France)
- The crystal structure of [(2,2′-bipyridine-6-carboxylato-κ3 N,N,O)-(6-phenylpyridine-2-carboxylate-κ2 N,O)copper(II)] monohydrate, C23H17N3O5Cu
- Crystal structure of bis(μ-benzeneselenolato)-(μ-[N-benzyl-N-(diphenylphosphanyl)-P,P-diphenylphosphinous amide])-tetracarbonyl diiron (Fe–Fe), C47H37Fe2NO4P2Se2
- The crystal structure of diaqua-methanol-κ1 O- (3-thiophenecarboxylato-κO)-(2,2′-dipyridyl-κ2 N,N′)manganese(II) 3-thiophenecarboxylate, C21H22N2O7S2Mn
- Crystal structure of catena-poly[tetrakis(butyl)-μ2-2-((oxido(phenyl)methylene)hydrazineylidene)propanoato-κ4 O:O,O′,N-μ2-2-((oxido(phenyl)methylene)hydrazineylidene)propanoato-κ4 O,N,O′:N′-ditin(IV)], C34H50N6O6Sn2
- Crystal structure of 4-chloro-N′-[(1E)-(2-nitrophenyl)methylidene]benzohydrazide, C14H10ClN3O3
- The crystal structure of 3-(1′-deoxy-3′,5′-O-dibenzy-β-d-ribosyl)adenine dichloromethane solvate, C49H52Cl2N10O6
- The crystal structure of (Z)-4-amino-N′-(1-(o-tolyl)ethylidene)benzohydrazide, C16H17N3O
- The co-crystal structure of etoricoxib–phthalic acid (1/1), C18H15ClN2O2S·C8H6O4
- Crystal structure of (glycinto-κ 2 O,N ′)-[5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ 4 N,N ′,N ″,N ‴]nickel(II) perchlorate monohydrate C18H42ClN5NiO7
- The crystal structure of catena-poly[bis(1-ethylimidazole-k1 N)-(μ 2-benzene-1-carboxyl-3,5-dicarboxylato-κ 2 O, O′)zinc(II)], C19H20N4O6Zn
- Crystal structure of 3-(thiazol-2-ylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, C11H12N2O4S
- Rietveld structure analysis of keatite, a rare, metastable SiO2 polymorph
- Crystal structure of catena-poly[(μ2-isophthalato-k3 O,O′:O″)(4-(4-pyridyl)-2,5-dipyrazylpyridine-k3 N,N′,N″)cobalt(II)] trihydrate C26H22N6O7Co1
- Crystal structure of 3,5–di-O-benzoyl-1,2-O-isopropylidene-α–D-ribose, C22H22O7
- The crystal structure of fac-tricarbonyl(6-bromo-2,2-bipyridine-κ2 N,N)-(nitrato-κO)rhenium(I), C13H7BrN3O6Re
- The crystal structure of (E)-N′-(4-hydroxy-3-methoxybenzylidene)-2-naphthohydrazide monohydrate, C19H18N2O4
- The crystal structure of 5,5′-diselanediyl-bis(2-hydroxybenzaldehyde), C14H10O4Se2
- The crystal structure of catena-poly[diaqua-m2-dicyanido-κ2 C:N-dicyanido-κ1 C-bis(4-(pyridin-4-yl)benzaldehyde-κ1N)iron(II)-platinum(II), C28H22N6O4PtFe
- Redetermination of the crystal structure of 5,14-dihydro-6,17-dimethyl-8,15-diphenyldibenzo(b,i)(1,4,8,11)tetra-azacyclotetradecine, C32H28N4
- Crystal structure of poly[(μ3-2-(3,5-dicarboxyphenyl) benzimidazole-6-carboxylato-κ4O:O:O′:O″)lead(II)] monohydrate, C16H10N2O7Pb
- The crystal structure of fac-tricarbonyl(2-pyridin-2-yl-quinoline-κ2 N,N′)-(pyrazole-κN)rhenium(I)nitrate, C20H14N4O3ReNO3
- Crystal structure of dibromo-dicarbonyl-bis(tricyclohexylphosphine)-osmium(II) dichloromethane solvate, C38H66Br2O2OsP2
- Crystal structure of poly[bis(μ 2-2,6-bis(1-imidazoly)pyridine-κ 2 N:N′)copper(II)] diperchlorate dihydrate, C22H22Cl2CuN10O10
- The crystal structure of fac-tricarbonyl(N-benzoyl-N,N-cyclohexylmethylcarbamimidothioato-κ2 S,O)-(pyridine-κN)rhenium(I), C23H24N3O4ReS
- Crystal structure of (E)-7-fluoro-2-(4-fluorobenzylidene)-3,4-dihydronaphthalen-1(2H)-one, C17H12F2O
- Synthesis and crystal structure of 1-((3R,10S,13S, 17S)-3-((2-methoxyphenyl)amino)-10,13-dimethylhexadecahydro-1H-cyclopenta[α]phenanthren-17-yl)ethan-1-one, C28H41NO2
- The crystal structure of fac-tricarbonyl((pyridin-2-yl)methanamino-κ2 N,N′)-((pyridin-2-yl)methanamino-κN)rhenium(I) nitrate, C15H16O3N4Re
- The crystal structure of (1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)-N-((1-(4-vinylbenzyl)-1H-benzo[d]imidazol-2-yl)methyl)methanamine-κ 4 N,N′,N″,N‴)tris(nitrato-kO,O′)-erbium(III), C29H27ErN8O9
- Crystal structure of tetracene-5,12-dione, C18H10O2
- Crystal structure of (3R,3aS,6R,6aR)-6-hexyl-3-methyltetrahydrofuro[3,4-b]furan-2,4-dione, C13H20O4
- The crystal structure of N′1,N′3-bis((E)-thiophen-2-ylmethylene)isophthalohydrazide monohydrate, C18H16N4O3S2
- Crystal structure of methyl ((4-aminobenzyl)sulfonyl)-L-prolinate, C13H18N2O4S
- Crystal structure of (E)-3-(3-methoxybenzylidene)benzofuran-2(3H)-one, C16H12O3
- Synthesis and crystal structure (E)-1-(4-bromo-2-hydroxyphenyl)-3-(dimethylamino)prop-2-en-1-one, C11H12BrNO2
- Synthesis and crystal structure of (S,E)-4-hydroxy-3-(2-((4aR,6aS,7R,10aS,10bR)-3,3,6a,10b-tetramethyl-8-methylenedecahydro-1H-naphtho[2,1-d][1,3]dioxin-7-yl)ethylidene)dihydrofuran-2(3H)-one, C23H34O5
- The crystal structure of N,N′-(1,2-phenylene)bis (2-((2-oxopropyl)selanyl)benzamide), C26H24N2O4Se2
- The crystal structure of 1-ethyl-2-nitro-imidazole oxide, C5H7N3O3
- The crystal structure of 2-(2-fluorophenyl)naphtho[2,1-d]thiazole, C17H10FNS
- Crystal structure of (E)-2,4-di-tert-butyl-6-(((2-fluorophenyl)imino) methyl)phenol, C21H26FNO
- Synthesis and crystal structure of 3-methyl-2-(methylthio)-4H-chromen-4-one, C12H12O2S
- Crystal structure of dithieno[2,3-d:2′,3′-d′]benzo[1,2-b:4,5-b′]dithiophene-5,10-dione, C14H4O2S4
- The crystal structure of dimethyl 2,2ʹ-((adamantane-1,3-diylbis(4,1-phenylene)) bis(oxy))diacetate, C28H32O6
- The crystal structure of N-(6-chloro-2-methyl-2H-indazol-5-yl)acetamide, C10H10ClN3O
- Crystal structure of triaqua-(5-bromoisophthalato-κ1 O)-(2,2′-bipyridine-κ2 N:N′)nickel(II) hydrate, C18H19BrN2NiO8
- The crystal structure of 2-amino-4-carboxypyridin-1-ium perchlorate, C6H7ClN2O6
- The crystal structure of catena-poly[5-aminonicotinic acid-k1 N-m2-bromido-copper(I)], Cu(C6N2H6O2)Br
- The crystal structure of 2,2-bis(3-methoxyphenyl)-1-tosyl-1,2-dihydro- 2λ4,3λ4 -[1,3,2]diazaborolo[4,5,1-ij]quinoline - dichloromethane (1/1)
- The crystal structure of catena-poly[bis(6-phenylpyridine-2-carboxylato-κ2 N,O)-(μ2-4,4′-bipyridne-κ2 N:N)cadmium(II)], C34H24N4O4Cd
- The crystal structure of 5,7-dinitropyrazolo[5,1-b]quinazolin-9(4H)-one, C10H5N5O5
- Crystal structure of rac-1,8-bis(2-carbamoylethyl)-5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane, C22H46N6O2
- The crystal structure of (E)-N ′-(2-bromobenzylidene)-2-naphthohydrazide, C36H26Br2N4O2
- The crystal structure of 5-nitronaphthoquinone, C10H5NO4
- The crystal structure of (S, R p )-4–benzhydrylideneamino-12-(4-tert-butyl oxazolin-2-yl)[2.2]paracyclophane, C36H36N2O
- Synthesis and crystal structure of 2-(2-oxo-2-(o-tolyl)ethyl)-4H-chromen-4-one, C18H14O3
- Crystal structure of 2-(thiazol-2-yl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, C11H10N2O3S
- Crystal structure of N-(diaminomethylene)-1-(dimethylamino)-1-iminiomethanaminium dichloride, C4H13Cl2N5
- Crystal structure of poly[(μ3-3, 5-dichloro-2-hydroxy-benzoato-κ4 Cl,O:O′:O″) silver(I)], C7H3AgCl2O3
- The crystal structure of tetrakis(1-isopropylimidazole-κ1 N)-[μ2- imidazole-4,5-dicarboxylato-κ4 O,N,O′,N′)]- trioxido-divanadium, C29H41N10O7V2
- Crystal structure of catena-[(μ3-bromido)-(1H-1,2,4-triazol-1-yl)benzoato-κ1 N)copper(I)], C9H7BrCuN3O2
- The crystal structure of (E)-4-fluoro-N′-(1-(2-hydroxyphenyl)propylidene)benzohydrazide, C16H15FN2O2