Abstract
C24H23FN2O4S, orthorhombic, Pbca (no. 19), a = 14.3646(18) Å, b = 15.5927(19) Å, c = 19.645(3) Å, V = 4400.1(10) Å3, Z = 8, Rgt(F) = 0.0349, wRref(F2) = 0.0982, T = 296(2) K.

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: | Block |
| Size: | 0.34 × 0.25 × 0.14 mm |
| Wavelength: | Mo Kα radiation (0.71073 Å) |
| μ: | 0.19 mm−1 |
| Diffractometer, scan mode: | Bruker APEX-II, φ and ω |
| θmax, completeness: | 25.1°, >99% |
| N(hkl)measured, N(hkl)unique, Rint: | 20955, 3916, 0.025 |
| Criterion for Iobs, N(hkl)gt: | Iobs > 2 σ(Iobs), 3324 |
| N(param)refined: | 290 |
| Programs: | SHELX [1], Bruker [2] |
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).
| Atom | x | y | z | Uiso*/Ueq |
|---|---|---|---|---|
| S1 | 0.64923(3) | 0.23860(3) | 0.53719(2) | 0.04382(14) |
| F1 | 0.56183(7) | 0.19174(7) | 0.34211(6) | 0.0596(3) |
| N1 | 0.84621(11) | 0.22597(10) | 0.61493(8) | 0.0564(4) |
| N2 | 0.67534(10) | 0.22113(8) | 0.45801(7) | 0.0436(3) |
| O1 | 0.88241(11) | 0.18576(9) | 0.56947(8) | 0.0724(4) |
| O2 | 0.84328(15) | 0.20273(11) | 0.67345(8) | 0.1040(7) |
| O3 | 0.67228(9) | 0.16309(7) | 0.57439(6) | 0.0547(3) |
| O4 | 0.55706(8) | 0.27155(8) | 0.53861(7) | 0.0596(3) |
| C1 | 0.80758(12) | 0.31134(10) | 0.59977(8) | 0.0440(4) |
| C2 | 0.85969(13) | 0.37999(13) | 0.62181(9) | 0.0574(5) |
| H2 | 0.9170 | 0.3710 | 0.6426 | 0.069* |
| C3 | 0.82649(14) | 0.46174(12) | 0.61289(10) | 0.0610(5) |
| H3 | 0.8616 | 0.5085 | 0.6272 | 0.073* |
| C4 | 0.74157(13) | 0.47428(11) | 0.58296(10) | 0.0560(5) |
| H4 | 0.7186 | 0.5297 | 0.5778 | 0.067* |
| C5 | 0.68984(12) | 0.40578(10) | 0.56049(8) | 0.0461(4) |
| H5 | 0.6323 | 0.4154 | 0.5401 | 0.055* |
| C6 | 0.72223(11) | 0.32248(9) | 0.56777(8) | 0.0390(3) |
| C7 | 0.65041(13) | 0.28694(11) | 0.40770(9) | 0.0505(4) |
| H7A | 0.6983 | 0.3307 | 0.4064 | 0.061* |
| H7B | 0.5923 | 0.3140 | 0.4207 | 0.061* |
| C8 | 0.64032(12) | 0.24653(11) | 0.33812(9) | 0.0483(4) |
| C9 | 0.72395(12) | 0.19219(10) | 0.31941(8) | 0.0455(4) |
| H9A | 0.7763 | 0.2300 | 0.3107 | 0.055* |
| H9B | 0.7103 | 0.1620 | 0.2774 | 0.055* |
| C10 | 0.75306(11) | 0.12599(10) | 0.37353(7) | 0.0390(3) |
| C11 | 0.76125(11) | 0.17418(10) | 0.44172(8) | 0.0414(4) |
| H11A | 0.7744 | 0.1334 | 0.4778 | 0.050* |
| H11B | 0.8128 | 0.2142 | 0.4393 | 0.050* |
| C12 | 0.61871(16) | 0.31316(14) | 0.28417(11) | 0.0692(6) |
| H12A | 0.6106 | 0.2854 | 0.2410 | 0.104* |
| H12B | 0.6692 | 0.3533 | 0.2813 | 0.104* |
| H12C | 0.5626 | 0.3430 | 0.2961 | 0.104* |
| C13 | 0.68651(11) | 0.04841(10) | 0.37521(8) | 0.0396(3) |
| C14 | 0.63639(12) | 0.02348(11) | 0.43217(9) | 0.0506(4) |
| H14 | 0.6388 | 0.0568 | 0.4714 | 0.061* |
| C15 | 0.58293(14) | −0.05027(12) | 0.43152(11) | 0.0616(5) |
| H15 | 0.5501 | −0.0659 | 0.4704 | 0.074* |
| C16 | 0.57754(14) | −0.10070(12) | 0.37467(11) | 0.0607(5) |
| H16 | 0.5414 | −0.1502 | 0.3746 | 0.073* |
| C17 | 0.62658(13) | −0.07693(12) | 0.31754(10) | 0.0571(5) |
| H17 | 0.6235 | −0.1104 | 0.2784 | 0.068* |
| C18 | 0.68040(12) | −0.00358(11) | 0.31804(8) | 0.0487(4) |
| H18 | 0.7134 | 0.0114 | 0.2791 | 0.058* |
| C19 | 0.85073(10) | 0.08953(10) | 0.35946(8) | 0.0399(3) |
| C20 | 0.88818(11) | 0.03089(10) | 0.40516(9) | 0.0464(4) |
| H20 | 0.8544 | 0.0163 | 0.4439 | 0.056* |
| C21 | 0.97393(12) | −0.00622(11) | 0.39462(9) | 0.0496(4) |
| H21 | 0.9980 | −0.0443 | 0.4265 | 0.060* |
| C22 | 1.02365(12) | 0.01291(13) | 0.33722(9) | 0.0568(5) |
| H22 | 1.0807 | −0.0133 | 0.3291 | 0.068* |
| C23 | 0.98860(14) | 0.07077(15) | 0.29204(10) | 0.0712(6) |
| H23 | 1.0224 | 0.0844 | 0.2531 | 0.085* |
| C24 | 0.90320(13) | 0.10971(14) | 0.30321(9) | 0.0610(5) |
| H24 | 0.8811 | 0.1500 | 0.2722 | 0.073* |
Source of material
The mixture solution of (diacetoxyiodo)benzene and fluoroboric acid in CH2Cl2 was stirred at room temperature for 10 min and N-(4-methyl-2,2-diphenylpent-4-en-1-yl)-2-nitrobenzenesulfonamide was added to continue the reaction for 10 min. The mixture was purified by flash column chromatography (petroleum ether/ethyl acetate = 20/1) to afford the title compound.
Experimental details
The Uiso values of the hydrogen atoms of methyl groups were set to 1.5 Ueq(C). Besides, the Uiso values of phenyl, methylene hydrogen atoms were set to 1.2 Ueq(C).
Comment
Fluorine-containing compounds are important building blocks for the synthesis of bioactive molecules [3], [4], [5]. The title structure can easily be deproted of sulfonyl protection [6], and then it could be transformed into a range of compounds containing a piperidine ring and a fluorine atom [7], [8], [9], [10], [11], [12]. These compounds have a wide range of biomedical activities.
The title structure contains a chair-type piperidine ring similar to the literature [13]. The angle between the fluorine atom and the methyl group attached to the C8 carbon atom on the piperidine ring is 106.79(15)°. The dihedral angles between the plane 1 of phenyl (C1, C2, C3, C4, C5 and C6) and the plane 2 of sulfonyl group (O3, S1 and O4), the plane 3 of nitryl (O1, N1 and O2) are 55.0(1)°, 75.2(1)°, respectively. Besides, the dihedral angle between the plane 2 and plane 3 is 52.8(1)°. The dihedral angle between two phenyl rings directly connected the piperidine ring is 83.534(55)°.
Acknowledgements
This work is supported by Shaanxi Province Key Research and Development Program (S2019-YF-ZDCXL-ZDLSF-0138).
References
1. Sheldrick, G. M.: A short history of SHELX. Acta Crystallogr. A64 (2008) 112–122.10.1107/S0108767307043930Suche in Google Scholar PubMed
2. Bruker. APEX2, SAINT and SADABS. Bruker AXS Inc., Madison, WI, USA (2009).Suche in Google Scholar
3. Asahina, Y.; Takei, M.; Kimura, T.; Fukuda, Y.: Synthesis and antibacterial activity of novel pyrido[1,2,3-de][1,4]benzoxazine- 6-carboxylic acid derivatives carrying the 3-cyclopropylaminomethyl-4-substituted-1-pyrrolidinyl group as a C-10 substituent. J. Med. Chem. 51 (2008) 3238–3249.10.1021/jm701428bSuche in Google Scholar PubMed
4. Tsai, T.; Yeh, T.; Chen, X.; Hsu, T.; Jao, Y.; Huang, C.; Song, J.; Huang, Y.; Chien, C.; Chiu, J.; Yen, S.; Tang, H.; Chao, Y.; Jiaang, W.: Substituted 4-carboxymethylpyroglutamic acid diamides as potent and selective inhibitors of fibroblast activation protein. J. Med. Chem. 53 (2010) 6572–6583.10.1021/jm1002556Suche in Google Scholar PubMed
5. Sharma, M.; Gupta, M.; Singh, D.; Kumar, M.; Kaur, P.: Synthesis, evaluation and molecular docking of prolyl-fluoropyrrolidine derivatives as dipeptidyl peptidase IV inhibitors. Chem. Biol. Drug Des. 82 (2013) 156–166.10.1111/cbdd.12142Suche in Google Scholar PubMed
6. Tamaddon, F.; Nasiri, A.; Farokhi, S.: CsF-Celite as an efficient heterogeneous catalyst for sulfonylation and desulfonylation of heteroatoms. Catal. Commun. 12 (2011) 1477–1482.10.1016/j.catcom.2011.04.005Suche in Google Scholar
7. Böhm, H.; Banner, D.; Bendels, S.; Kansy, M.; Kuhn, B.; Müller, K.; Obst-Sander, U.; Stahl, M.: Fluorine in medicinal chemistry. ChemBioChem 5 (2004) 637–643.10.1002/cbic.200301023Suche in Google Scholar PubMed
8. Hagmann, W. K.: The many roles for fluorine in medicinal chemistry. J. Med. Chem. 51 (2008) 4359–4369.10.1021/jm800219fSuche in Google Scholar PubMed
9. Muller, K.; Faeh, C.; Diederich, F.: Fluorine in pharmaceuticals: looking beyond intuition. Science 317 (2007) 1881–1886.10.1126/science.1131943Suche in Google Scholar PubMed
10. Schweizer, E.; Hoffmann-Röder, A.; Schärer, K.; Olsen, J. A.; Fäh, C.; Seiler, P.; Obst-Sander, U.; Wagner, B.; Kansy, M.; Diederich, F.: A fluorine scan at the catalytic center of thrombin: C-F, C-OH, and C-OMe bioisosterism and fluorine effects on pKa and logD values. ChemMedChem 1 (2006) 611–621.10.1002/cmdc.200600015Suche in Google Scholar PubMed
11. Martino, R.; Gilard, V.; Desmoulin, F.; Malet-Martino, M.: Interest of fluorine-19 nuclear magnetic resonance spectroscopy in the detection, identification and quantification of metabolites of anticancer and antifungal fluoropyrimidine drugs in human biofluids. Chemotherapy 52 (2006) 215–219.10.1159/000094744Suche in Google Scholar PubMed
12. Sun, S.; Adejare, A.: Fluorinated molecules as drugs and imaging agents in the CNS. Curr. Top. Med. Chem. 6 (2006) 1457–1464.10.2174/156802606777951046Suche in Google Scholar PubMed
13. Prasad, S. B. B.; Naveen, S.; Anandakumar, C. S.; Vinaya, K.; Gowda, N. S. L.; Sridhar, M. A.; Prasad, J. S.; Rangappa, K. S.: Synthesis and crystal structure of 1-(2-nitro-benzenesulfonyl)-piperidin-4-yl-diphenyl-methanol. Mol. Cryst. Liq. Cryst. 482 (2008) 145–154.10.1080/15421400801914988Suche in Google Scholar
©2019 Zedong Cai et al., published by De Gruyter, Berlin/Boston
This work is licensed under the Creative Commons Attribution 4.0 Public License.
Artikel in diesem Heft
- Frontmatter
- Crystal structure of [aqua[2,2′-(1,2-phenylene)bis(1H-imidazole-4-carboxylato-5-carboxy)-κ4N3,N3′,O4,O4′] zinc(II)] monohydrate, C16H10N4O9Zn⋅H2O
- Crystal structure of ethyl 3-(4-methoxyphenyl)-5-methylcarbamoyl-1H-pyrazole-4-carboxylate, C15H17N3O4
- 7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-N-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carbothioamide–dimethylformamide (2/1), C27H23F2N3S, 0.5(C3H7NO)
- Crystal structure of 4,4′-(hydrazonomethylene)diphenol dihydrate, C13H16N2O4
- Crystal structure of 4-methoxyphenyl-3-phenylpropiolate, C16H12O3
- Crystal Structure of tris(tetrakis{1-vinyl-1H-imidazole-κN}copper(II)) bis[tri-μ2-bromido-tetrabromido-bis(1-vinyl-1H-imidazole-κN)tetracopper(I)], C80H96N32Cu11Br14
- Crystal structure of (E)-2-(3,6-bis(diethylamino)-9H-xanthen-9-yl)-N′-(quinoxalin-2-ylmethylene)benzohydrazide, C37H36N6O2
- Crystal structure of 4-(1-phenylimidazo[1,5-a]pyridin-3-yl)benzoic acid (C20H14N2O2)
- Crystal structure of 3-fluoro-3-methyl-1-((2-nitrophenyl)sulfonyl)-5,5-diphenylpiperidine, C24H23FN2O4S
- Crystal structure of dimethyl 3,12-dibenzyl-6,10-diphenyl-3,12-diazapentacyclo [6.3.1.02.7.04.11.05.9]-dodecane-7,11-dicarboxylate — acetone (2/1), C40H38N2O2 ⋅ 0.5C3H6O
- Crystal structure of poly[(μ2-2-(1H-1,2,4-triazol-1-yl)benzoato-κ4O:O′:N:N′)silver(I)] monohydrate, C9H8AgO3N3
- Crystal structure of poly[(μ2-9H-carbazole-3,6-dicarboxylate-κ4O1,O2:O3,O4)(μ2-1,3-di(pyridin-4-yl)propane-κ2N:N′)cadmium(II)]monohydrate, C27H23N3O5Cd
- The synthesis and crystal structure of bis(2-(benzo[d]thiazol-2-yl)-5-methylbenzen-1-ido-κ2C,N)-(N,N′-diethyldithiocarbamato-κ2S,S′)iridium(III), C33H30N3S4Ir
- The crystal structure of 5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-(trifluoromethylsulfonyl)-1H-pyrazole-3-carboxamide, C12H6N4Cl2F6O3S
- Synthesis and crystal structure of poly[(μ2-nitrato-κ4O,O′:O′,O′′)-nitrato-κO-(μ2-1,4-bis((1H-imidazol-1-yl)methyl)benzene-κ2N:N′)cadmium(II)], C14H14N6O6Cd
- Crystal structure of ethyl (Z)-(4-oxo-4-phenylbut-2-en-2-yl)glycinate, C14H17NO3
- Halogen bonds in the crystal structure of 5-bromo-3,4′-bipyridine – 1,4-diiodotetrafluorobenzene (2/1), C26H14Br2F4I2N4
- Crystal structure of bis(2,2′-bipyridine-κ2N,N′)-tetrakis(μ2-3-(phenylsulfonamido)propanoato-κ2O:O′)-bis(3-(phenylsulfonamido)propanoato-κ2O,O′)digadolinium(III) – 2,2′-bipyridine (1/1), C84H84Gd2N12O24S6
- Crystal structure of poly[aqua(μ2-2-amino-1,4-benzenedisulfonato-κ2O:O′)bis(μ2-pyrazin-κ2N:N′)silver(I)], C14H16Ag2N5O8S2
- The crystal structure of 1,6-di-tert-butyl-1,1,3,3,4,4,6,6-octamethyl-2,2,5,5-tetrakis (trimethylsilyl)hexasilane, C28H78Si10
- Crystal structure of discandium triruthenium tetrasilicide, Sc2Ru3Si4
- Crystal structure of poly[(μ2-4-amino-1,5-naphthalenedisulfonato-κ4O,N:O′, N′)bis(μ2-hexamethylenetetramino-κ2N;N′)silver(I)], {C22H30Ag2N9O6S2}n
- Crystal structure of diaqua[5,5′-dicarboxy-2,2′-(propane-1,3-diyl)bis(1H-imidazole-4-carboxylato-κ4O,O′,N,N′)]zinc(II) dihydrate, C13H18N4O12Zn
- The crystal structure of poly [(μ3-N1,N4-bis(pyridin-3-yl)cyclohexane-1,4-dicarboxamide-κ3-O:N:N′)-(p-toluenesulfonato-κ2O,O′)silver(I)], C25H27Ag1N4O5S
- The crystal structure of 1,2-bis(3-bromophenoxy) ethane, C14H12Br2O2
- The crystal structure of 4-(pyren-1-yl)butyl-3-nitrobenzoate, C27H21NO4
- Crystal structure of bis[(2-(4-chlorophenyl)-5-methyl-1,3-dioxane-5-carboxylato-κ1O) (5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′)]nickel(II), C40H60Cl2N4NiO8
- The crystal structure of 1,5-dinitro-2,3,4-trichlorobenzene, C6H1Cl3N2O4
- The crystal structure of the solid solution of 3,5-dinitropyrazole and 4-chlorine-3,5-dinitropyrazole, C3H1.24Cl0.76N4O4
- The cocrystal structure of 4-nitropyrazole — acetic acid (1/1), C5H7N3O4
- The crystal structure of propan-2-one O-(2,4,6-trinitrophenyl) oxime, C9H8N4O7
- The crystal structure of ethyl 2-(3-(2-ethoxy-2-oxoethyl)benzo[d] thiazol-2(3H)-ylidene)acetate, C15H17NO4S
- Crystal structure of (acetic acid-κ1O)-bis(μ2-2-chlorobenzoato-κ2O:O′)-(2-chlorobenzoato-κ1O)-(μ2-hydroxy-κ2O:O)-bis(1,10-phenanthroline-κ2N,N′)dimanganese(II) — methanol (1/1), C48H37Cl3Mn2N4O10
- Crystal structure of 3-methyl-2-phenyl-1,8-naphthyridine, C15H12N2
- Crystal structure of chlorido-(5-acetyl-2-(5-methylpyridin-2-yl)benzen-1-ido-κ2C,N)-pyridine-κN-palladium(II), C19H17ClN2OPd
- Crystal structure of (4-methyl-benzoato-κ2O,O′)-(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′)nickel(II) perchlorate monohydrate, C24H45ClN4NiO7
- Crystal structure of (1,4,7,10,13,16-hexaoxacyclooctadecane-κ6O6) 1,2,3,4,5-pentamethyl-cyclopenta-2,4-dien-1-yl(potassium, rubidium) — ammonia (1/2), [K0.3Rb0.7(18-crown-6)]Cp*⋅2 NH3, C22H45K0.3N2O6Rb0.7
- Crystal structure of (3E,5E)-1-((4-fluorophenyl)sulfonyl)-3,5-bis(3-nitrobenzylidene)piperidin-4-one — dichloromethane (2/1), C51H38Cl2F2N6O14S2
- Crystal structure of (E)-N′-((1,6-dihydropyren-1-yl)methylene)isonicotinohydrazide — methanol (1/1), C24H19N3O2
- Crystal structure of poly[aqua(μ2-2-amino-1,4-benzenedisulfonato-κ3N,O:O′)-(μ4-hexamethylenetetramino-κ4N:N′:N′′:N′′′)disilver(I)] monohydrate, C12H21Ag2N5O8S2
- Crystal structure of bis(acridin-10-ium) 2,5-dihydroxyterephthalate — 2,5-dihydroxyterephthalic acid (1/1), C21H15NO6
- The crystal structure of 1,12-diazaperylene, C18H10N2
- Crystal structure of 1-(5-(4-chlorophenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one, C17H14N2OFCl
- Crystal structure of (4aR,6aR,6bR,10S,12aR)-10-acetoxy-1,2,3,4, 4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a, 12b,13,14b-icosahydro-2,2,4a,6b,9,9,12a-heptamethylpicene-6a-carboxylic acid, C32H50O4
- The crystal structure of tetrachlorido-bis{1,3-bis(2,6-diisopropylphenyl)-1H-3λ4-imidazol-2-yl}-(μ2-pyrimidine-κ2N:N′)dipalladium(IV) — dichloromethane (1/2), C60H80Cl8N6Pd2
- The crystal structure of (E)-4-(7-methoxy-2-oxo-2H-chromen-8-yl)-2-methylbut-2-en-1-yl 4-nitrobenzoate, C22H19NO7
- Crystal structure of 3-methyl-N-(pyrimidin-5-ylmethyl)pyridin-2-amine, C11H12N4
- The crystal structure of 2,5-dichloroterephthalic acid dihydrate, C8H8Cl2O6
- The crystal structure of 2,4,6-tris[4-(1H-imidazol-1-yl)phenyl]-1,3,5-triazine — dimethylformamide (1/1), C33H28N10O
- Crystal structure of N-(adamantan-1-yl)-5-(dimethylamino)naphthalene-1-sulfonamide, C22H28N2O2S
- Crystal structure of poly[diaqua-(μ4-4-(3,5-dicarboxy-κ1O-phenoxy)phthalato-κ3O:O′:O′)cadmium(II)], C16H12CdO11
- Crystal structure of poly[diaqua-bis(μ2-3-((1H-imidazol-1-yl)methyl)benzoato-κ2N:O)manganese(II)], C22H22MnN4O6
- Crystal structure of 9-(3-phenoxyphenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione, C25H23NO3
- The crystal structure of poly[(μ3-2,4,6-tris[4-(1H-imidazol-1-yl)phenyl]-1,3,5-triazine-k3N:N′:N′′)-(nitrato-k2O,O)-(nitrato-k1O)zinc(II)] - N,N-dimethylacetamide (1/2), C38H39N13O8Zn
- Crystal structure of poly[(μ7-4-(3,5-dicarboxylatophenoxy)phthalato)-(1,10-phenanthroline-κ2N,N′)dizinc(II)], C28H14N2O9Zn2
- The crystal structure of methyl 2-(benzylamino)-5-(benzyloxy)benzoate, C22H21NO3
- Crystal structure of (1,4,8,11-tetraazacyclotetradecane)palladium(II) tetracyanoplatinate(II), C14H24N8PdPt
- Crystal structure of (pyridine-2-carboxylato-κ2N,O)-[2-(2-pyridyl)phenyl-κ2N,C1]palladium(II), C17H12N2O2Pd
- Crystal structure of (cyclohexane-1,4-diammonium) 4-[(4-carboxylatophenyl)disulfanyl]benzoate dimethylsulphoxide hydrate (1/1/1/1), [C6H16N2]2+[C14H8O4S2]2−⋅C2H6OS⋅H2O
- Crystal structure of the 2:1 co-crystal 2-[(2-carboxyphenyl)disulfanyl]benzoic acid – 3-bromobenzoic acid, 2(C14H10O4S2)⋅C7H5BrO2
- Crystal structure of chlorido-dimethyl-(phenylpiperazine-1-carbodithioato-κ2S,S′)tin(IV), C13H19ClN2S2Sn
- Crystal structure of (N-n-butyl, N-methyl-dithiocarbamato-κ2 S,S′)-chlorido-dimethyl-tin(IV), C8H18ClNS2Sn
- Crystal structure of (2,2′-bipyridyl)bis(4-bromobenzyl)dibromidotin(IV), C24H20Br4N2Sn
- Crystal structure of (2,2′-bipyridyl)bis(4-chlorobenzyl)dichloridotin(IV), C24H20Cl4N2Sn
- Crystal structure of N-methyl-N-phenyl(methylsulfanyl)carbothioamide, C9H11NS2
- Crystal structure of 4-phenylpiperazin-1-ium (4-phenylpiperazin-1-yl)carbothioylsulfanide, [C10H15N2][C11H13N2S2]
- Crystal structure of catena-{di-aqua-sodium [n-butyl(methyl)carbamothioyl]sulfanide}n, [C6H16NNaO2S2]n
- Crystal structure of (2-([1,1-bis(hydroxymethyl)-2-oxyethyl]iminomethyl)-5-(n-decyl)phenolato)-dimethyl-tin(IV), C23H39NO5Sn
- Crystal structure of 4-chloro-N′-[(1E)-(3-ethoxy-2-hydroxyphenyl)methylidene]benzohydrazide – a Z′ = 3 structure, C16H15ClN2O3
Artikel in diesem Heft
- Frontmatter
- Crystal structure of [aqua[2,2′-(1,2-phenylene)bis(1H-imidazole-4-carboxylato-5-carboxy)-κ4N3,N3′,O4,O4′] zinc(II)] monohydrate, C16H10N4O9Zn⋅H2O
- Crystal structure of ethyl 3-(4-methoxyphenyl)-5-methylcarbamoyl-1H-pyrazole-4-carboxylate, C15H17N3O4
- 7-(4-Fluorobenzylidene)-3-(4-fluorophenyl)-N-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carbothioamide–dimethylformamide (2/1), C27H23F2N3S, 0.5(C3H7NO)
- Crystal structure of 4,4′-(hydrazonomethylene)diphenol dihydrate, C13H16N2O4
- Crystal structure of 4-methoxyphenyl-3-phenylpropiolate, C16H12O3
- Crystal Structure of tris(tetrakis{1-vinyl-1H-imidazole-κN}copper(II)) bis[tri-μ2-bromido-tetrabromido-bis(1-vinyl-1H-imidazole-κN)tetracopper(I)], C80H96N32Cu11Br14
- Crystal structure of (E)-2-(3,6-bis(diethylamino)-9H-xanthen-9-yl)-N′-(quinoxalin-2-ylmethylene)benzohydrazide, C37H36N6O2
- Crystal structure of 4-(1-phenylimidazo[1,5-a]pyridin-3-yl)benzoic acid (C20H14N2O2)
- Crystal structure of 3-fluoro-3-methyl-1-((2-nitrophenyl)sulfonyl)-5,5-diphenylpiperidine, C24H23FN2O4S
- Crystal structure of dimethyl 3,12-dibenzyl-6,10-diphenyl-3,12-diazapentacyclo [6.3.1.02.7.04.11.05.9]-dodecane-7,11-dicarboxylate — acetone (2/1), C40H38N2O2 ⋅ 0.5C3H6O
- Crystal structure of poly[(μ2-2-(1H-1,2,4-triazol-1-yl)benzoato-κ4O:O′:N:N′)silver(I)] monohydrate, C9H8AgO3N3
- Crystal structure of poly[(μ2-9H-carbazole-3,6-dicarboxylate-κ4O1,O2:O3,O4)(μ2-1,3-di(pyridin-4-yl)propane-κ2N:N′)cadmium(II)]monohydrate, C27H23N3O5Cd
- The synthesis and crystal structure of bis(2-(benzo[d]thiazol-2-yl)-5-methylbenzen-1-ido-κ2C,N)-(N,N′-diethyldithiocarbamato-κ2S,S′)iridium(III), C33H30N3S4Ir
- The crystal structure of 5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-(trifluoromethylsulfonyl)-1H-pyrazole-3-carboxamide, C12H6N4Cl2F6O3S
- Synthesis and crystal structure of poly[(μ2-nitrato-κ4O,O′:O′,O′′)-nitrato-κO-(μ2-1,4-bis((1H-imidazol-1-yl)methyl)benzene-κ2N:N′)cadmium(II)], C14H14N6O6Cd
- Crystal structure of ethyl (Z)-(4-oxo-4-phenylbut-2-en-2-yl)glycinate, C14H17NO3
- Halogen bonds in the crystal structure of 5-bromo-3,4′-bipyridine – 1,4-diiodotetrafluorobenzene (2/1), C26H14Br2F4I2N4
- Crystal structure of bis(2,2′-bipyridine-κ2N,N′)-tetrakis(μ2-3-(phenylsulfonamido)propanoato-κ2O:O′)-bis(3-(phenylsulfonamido)propanoato-κ2O,O′)digadolinium(III) – 2,2′-bipyridine (1/1), C84H84Gd2N12O24S6
- Crystal structure of poly[aqua(μ2-2-amino-1,4-benzenedisulfonato-κ2O:O′)bis(μ2-pyrazin-κ2N:N′)silver(I)], C14H16Ag2N5O8S2
- The crystal structure of 1,6-di-tert-butyl-1,1,3,3,4,4,6,6-octamethyl-2,2,5,5-tetrakis (trimethylsilyl)hexasilane, C28H78Si10
- Crystal structure of discandium triruthenium tetrasilicide, Sc2Ru3Si4
- Crystal structure of poly[(μ2-4-amino-1,5-naphthalenedisulfonato-κ4O,N:O′, N′)bis(μ2-hexamethylenetetramino-κ2N;N′)silver(I)], {C22H30Ag2N9O6S2}n
- Crystal structure of diaqua[5,5′-dicarboxy-2,2′-(propane-1,3-diyl)bis(1H-imidazole-4-carboxylato-κ4O,O′,N,N′)]zinc(II) dihydrate, C13H18N4O12Zn
- The crystal structure of poly [(μ3-N1,N4-bis(pyridin-3-yl)cyclohexane-1,4-dicarboxamide-κ3-O:N:N′)-(p-toluenesulfonato-κ2O,O′)silver(I)], C25H27Ag1N4O5S
- The crystal structure of 1,2-bis(3-bromophenoxy) ethane, C14H12Br2O2
- The crystal structure of 4-(pyren-1-yl)butyl-3-nitrobenzoate, C27H21NO4
- Crystal structure of bis[(2-(4-chlorophenyl)-5-methyl-1,3-dioxane-5-carboxylato-κ1O) (5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′)]nickel(II), C40H60Cl2N4NiO8
- The crystal structure of 1,5-dinitro-2,3,4-trichlorobenzene, C6H1Cl3N2O4
- The crystal structure of the solid solution of 3,5-dinitropyrazole and 4-chlorine-3,5-dinitropyrazole, C3H1.24Cl0.76N4O4
- The cocrystal structure of 4-nitropyrazole — acetic acid (1/1), C5H7N3O4
- The crystal structure of propan-2-one O-(2,4,6-trinitrophenyl) oxime, C9H8N4O7
- The crystal structure of ethyl 2-(3-(2-ethoxy-2-oxoethyl)benzo[d] thiazol-2(3H)-ylidene)acetate, C15H17NO4S
- Crystal structure of (acetic acid-κ1O)-bis(μ2-2-chlorobenzoato-κ2O:O′)-(2-chlorobenzoato-κ1O)-(μ2-hydroxy-κ2O:O)-bis(1,10-phenanthroline-κ2N,N′)dimanganese(II) — methanol (1/1), C48H37Cl3Mn2N4O10
- Crystal structure of 3-methyl-2-phenyl-1,8-naphthyridine, C15H12N2
- Crystal structure of chlorido-(5-acetyl-2-(5-methylpyridin-2-yl)benzen-1-ido-κ2C,N)-pyridine-κN-palladium(II), C19H17ClN2OPd
- Crystal structure of (4-methyl-benzoato-κ2O,O′)-(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradecane-κ4N,N′,N′′,N′′′)nickel(II) perchlorate monohydrate, C24H45ClN4NiO7
- Crystal structure of (1,4,7,10,13,16-hexaoxacyclooctadecane-κ6O6) 1,2,3,4,5-pentamethyl-cyclopenta-2,4-dien-1-yl(potassium, rubidium) — ammonia (1/2), [K0.3Rb0.7(18-crown-6)]Cp*⋅2 NH3, C22H45K0.3N2O6Rb0.7
- Crystal structure of (3E,5E)-1-((4-fluorophenyl)sulfonyl)-3,5-bis(3-nitrobenzylidene)piperidin-4-one — dichloromethane (2/1), C51H38Cl2F2N6O14S2
- Crystal structure of (E)-N′-((1,6-dihydropyren-1-yl)methylene)isonicotinohydrazide — methanol (1/1), C24H19N3O2
- Crystal structure of poly[aqua(μ2-2-amino-1,4-benzenedisulfonato-κ3N,O:O′)-(μ4-hexamethylenetetramino-κ4N:N′:N′′:N′′′)disilver(I)] monohydrate, C12H21Ag2N5O8S2
- Crystal structure of bis(acridin-10-ium) 2,5-dihydroxyterephthalate — 2,5-dihydroxyterephthalic acid (1/1), C21H15NO6
- The crystal structure of 1,12-diazaperylene, C18H10N2
- Crystal structure of 1-(5-(4-chlorophenyl)-3-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one, C17H14N2OFCl
- Crystal structure of (4aR,6aR,6bR,10S,12aR)-10-acetoxy-1,2,3,4, 4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a, 12b,13,14b-icosahydro-2,2,4a,6b,9,9,12a-heptamethylpicene-6a-carboxylic acid, C32H50O4
- The crystal structure of tetrachlorido-bis{1,3-bis(2,6-diisopropylphenyl)-1H-3λ4-imidazol-2-yl}-(μ2-pyrimidine-κ2N:N′)dipalladium(IV) — dichloromethane (1/2), C60H80Cl8N6Pd2
- The crystal structure of (E)-4-(7-methoxy-2-oxo-2H-chromen-8-yl)-2-methylbut-2-en-1-yl 4-nitrobenzoate, C22H19NO7
- Crystal structure of 3-methyl-N-(pyrimidin-5-ylmethyl)pyridin-2-amine, C11H12N4
- The crystal structure of 2,5-dichloroterephthalic acid dihydrate, C8H8Cl2O6
- The crystal structure of 2,4,6-tris[4-(1H-imidazol-1-yl)phenyl]-1,3,5-triazine — dimethylformamide (1/1), C33H28N10O
- Crystal structure of N-(adamantan-1-yl)-5-(dimethylamino)naphthalene-1-sulfonamide, C22H28N2O2S
- Crystal structure of poly[diaqua-(μ4-4-(3,5-dicarboxy-κ1O-phenoxy)phthalato-κ3O:O′:O′)cadmium(II)], C16H12CdO11
- Crystal structure of poly[diaqua-bis(μ2-3-((1H-imidazol-1-yl)methyl)benzoato-κ2N:O)manganese(II)], C22H22MnN4O6
- Crystal structure of 9-(3-phenoxyphenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione, C25H23NO3
- The crystal structure of poly[(μ3-2,4,6-tris[4-(1H-imidazol-1-yl)phenyl]-1,3,5-triazine-k3N:N′:N′′)-(nitrato-k2O,O)-(nitrato-k1O)zinc(II)] - N,N-dimethylacetamide (1/2), C38H39N13O8Zn
- Crystal structure of poly[(μ7-4-(3,5-dicarboxylatophenoxy)phthalato)-(1,10-phenanthroline-κ2N,N′)dizinc(II)], C28H14N2O9Zn2
- The crystal structure of methyl 2-(benzylamino)-5-(benzyloxy)benzoate, C22H21NO3
- Crystal structure of (1,4,8,11-tetraazacyclotetradecane)palladium(II) tetracyanoplatinate(II), C14H24N8PdPt
- Crystal structure of (pyridine-2-carboxylato-κ2N,O)-[2-(2-pyridyl)phenyl-κ2N,C1]palladium(II), C17H12N2O2Pd
- Crystal structure of (cyclohexane-1,4-diammonium) 4-[(4-carboxylatophenyl)disulfanyl]benzoate dimethylsulphoxide hydrate (1/1/1/1), [C6H16N2]2+[C14H8O4S2]2−⋅C2H6OS⋅H2O
- Crystal structure of the 2:1 co-crystal 2-[(2-carboxyphenyl)disulfanyl]benzoic acid – 3-bromobenzoic acid, 2(C14H10O4S2)⋅C7H5BrO2
- Crystal structure of chlorido-dimethyl-(phenylpiperazine-1-carbodithioato-κ2S,S′)tin(IV), C13H19ClN2S2Sn
- Crystal structure of (N-n-butyl, N-methyl-dithiocarbamato-κ2 S,S′)-chlorido-dimethyl-tin(IV), C8H18ClNS2Sn
- Crystal structure of (2,2′-bipyridyl)bis(4-bromobenzyl)dibromidotin(IV), C24H20Br4N2Sn
- Crystal structure of (2,2′-bipyridyl)bis(4-chlorobenzyl)dichloridotin(IV), C24H20Cl4N2Sn
- Crystal structure of N-methyl-N-phenyl(methylsulfanyl)carbothioamide, C9H11NS2
- Crystal structure of 4-phenylpiperazin-1-ium (4-phenylpiperazin-1-yl)carbothioylsulfanide, [C10H15N2][C11H13N2S2]
- Crystal structure of catena-{di-aqua-sodium [n-butyl(methyl)carbamothioyl]sulfanide}n, [C6H16NNaO2S2]n
- Crystal structure of (2-([1,1-bis(hydroxymethyl)-2-oxyethyl]iminomethyl)-5-(n-decyl)phenolato)-dimethyl-tin(IV), C23H39NO5Sn
- Crystal structure of 4-chloro-N′-[(1E)-(3-ethoxy-2-hydroxyphenyl)methylidene]benzohydrazide – a Z′ = 3 structure, C16H15ClN2O3