Startseite Crystal structure of 1-cyclohexyl-4-p-tolyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester, C22H27NO4
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Crystal structure of 1-cyclohexyl-4-p-tolyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester, C22H27NO4

  • Yucong Liu ORCID logo , Zhihui Zhang , Ran Zhou , Yannan Ji , Yanlong Lan , Ruixia Guo , Haixia Wu ORCID logo EMAIL logo und Jingyu He ORCID logo EMAIL logo
Veröffentlicht/Copyright: 18. Juni 2024
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Zeitschrift für Kristallographie - New Crystal Structures
Aus der Zeitschrift Zeitschrift für Kristallographie - New Crystal Structures Band 239 Heft 4

Abstract

C22H27NO4, triclinic, P 1 ‾ (no. 2), a = 9.3356(8) Å, b = 10.2842(11) Å, c = 11.5902(12) Å, α = 103.266(4)°, β = 106.189(3)°, γ = 97.779(4)°, V = 1016.20(18) Å3, Z = 2, R gt (F) = 0.0413, wRref (F 2) = 0.0928, T = 293 K.

CCDC no.: 2344807

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.

Table 1:

Data collection and handling.

Crystal: Yellow block
Size: 0.25 × 0.23 × 0.20 mm
Wavelength: Mo Kα radiation (0.71073 Å)
μ: 0.08 mm−1
Diffractometer, scan mode: Bruker APEX-II, φ and ω
θ max, completeness: 25.0°, >99 %
N(hkl)measured, N(hkl)unique, R int: 27,085, 3,566, 0.044
Criterion for I obs, N(hkl)gt: I obs > 2σ (I obs), 3,180
N(param)refined: 247
Programs: Bruker, 1 , 2 Shelx 3 , 4
Table 2:

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).

Atom x y z U iso*/U eq
C1 0.94039 (16) 0.25010 (14) 0.45807 (13) 0.0405 (3)
H1 1.045627 0.278560 0.495346 0.049*
C2 0.87877 (15) 0.25380 (13) 0.33990 (12) 0.0366 (3)
C3 0.70787 (15) 0.22522 (14) 0.27723 (12) 0.0367 (3)
H3 0.683159 0.168153 0.191095 0.044*
C4 0.63172 (15) 0.14576 (14) 0.34767 (13) 0.0382 (3)
C5 0.70392 (15) 0.14563 (14) 0.46500 (13) 0.0404 (3)
H5 0.649160 0.102565 0.506657 0.048*
C6 0.97439 (16) 0.28364 (14) 0.26437 (13) 0.0409 (3)
C7 1.2264 (2) 0.3446 (2) 0.26052 (18) 0.0707 (5)
H7A 1.220462 0.261508 0.199480 0.106*
H7B 1.328872 0.376870 0.317312 0.106*
H7C 1.198218 0.412492 0.219013 0.106*
C8 0.47245 (16) 0.07021 (15) 0.28922 (14) 0.0437 (3)
C9 0.2743 (2) −0.0260 (2) 0.09521 (19) 0.0812 (7)
H9A 0.266644 −0.117248 0.103395 0.122*
H9B 0.252897 −0.029066 0.008553 0.122*
H9C 0.201937 0.015851 0.127018 0.122*
C10 0.64964 (14) 0.35639 (14) 0.27381 (12) 0.0364 (3)
C11 0.67890 (18) 0.46035 (16) 0.38298 (14) 0.0484 (4)
H11 0.736839 0.450582 0.458786 0.058*
C12 0.62356 (19) 0.57810 (17) 0.38112 (16) 0.0557 (4)
H12 0.645306 0.646385 0.455590 0.067*
C13 0.53646 (18) 0.59605 (17) 0.27045 (17) 0.0528 (4)
C14 0.50708 (18) 0.49276 (18) 0.16245 (16) 0.0549 (4)
H14 0.448130 0.502279 0.086873 0.066*
C15 0.56313 (17) 0.37478 (16) 0.16342 (14) 0.0465 (4)
H15 0.542117 0.307146 0.088654 0.056*
C16 0.4758 (3) 0.7247 (2) 0.2686 (2) 0.0862 (7)
H16A 0.519028 0.772240 0.219800 0.129*
H16B 0.503191 0.782540 0.352576 0.129*
H16C 0.366667 0.701122 0.232092 0.129*
C17 0.92787 (16) 0.20593 (15) 0.65749 (13) 0.0427 (3)
H17 0.846732 0.168943 0.686919 0.051*
C18 1.0000 (2) 0.34911 (17) 0.74224 (15) 0.0599 (4)
H18A 0.923310 0.404367 0.737546 0.072*
H18B 1.079021 0.390275 0.714243 0.072*
C19 1.0694 (3) 0.3471 (2) 0.87780 (16) 0.0717 (5)
H19A 1.120664 0.439092 0.929443 0.086*
H19B 0.988584 0.315542 0.908776 0.086*
C20 1.1817 (2) 0.2547 (2) 0.88788 (16) 0.0689 (5)
H20A 1.268611 0.292667 0.866703 0.083*
H20B 1.218284 0.250514 0.973645 0.083*
C21 1.1115 (2) 0.1131 (2) 0.80287 (16) 0.0680 (5)
H21A 1.033212 0.070668 0.830861 0.082*
H21B 1.189118 0.058852 0.807317 0.082*
C22 1.0413 (2) 0.11418 (18) 0.66790 (15) 0.0610 (5)
H22A 1.121438 0.145755 0.636349 0.073*
H22B 0.990345 0.021862 0.616790 0.073*
N1 0.85504 (13) 0.20614 (13) 0.52659 (11) 0.0436 (3)
O1 0.92580 (13) 0.27710 (14) 0.15519 (10) 0.0639 (3)
O2 1.12405 (12) 0.31900 (13) 0.32894 (10) 0.0590 (3)
O3 0.42612 (13) 0.05273 (12) 0.16516 (10) 0.0612 (3)
O4 0.39079 (12) 0.02697 (13) 0.34210 (11) 0.0618 (3)

1 Source of material

4–Methylbenzaldehyde (6.5043 g, 0.0541 mol), methyl propiolate (9.1022 g, 0.1082 mol) and acetic acid (catalytic dose) were added to a 500 ml three-necked flask. After the reaction solution was heated to 90 °C, cyclohexylamine (5.3685 g, 0.0541 mol) was added and refluxed for 3 h, then naturally cooled to room temperature. A yellow precipitate was collected and recrystallized from 95 % ethanol, yield 73.5 %. Yellow block crystals were obtained from the filtrate by recrystallization.

2 Experimental details

Using Bruker APEX2 and Bruker SAINT, 1 the structure was solved with the Sheletl (Bruker, 2008) 2 structure solution program and refined with the Shelxl2018/3 (Sheldrick, 2018) 3 , 4 refinement package.

3 Comment

1,4–Dihydropyridine is a very important class of nitrogen-containing heterocyclic compounds, which has been widely used in biology, medicine and organic catalysis. 5 So far, many attempts have been made by researchers to synthesize them, such as ultrasonic method, 6 metal catalysis, 7 nano catalysis, 8 acid catalysis, 9 enzyme catalysis 10 and so on.

The title compound crystallizes in the triclinic space group, P 1 ‾ . The conformational details and atom numbering of the title compound are shown in the Figure 1. 1,4–Dihydropyridine ring adopts a flat-boat conformation when the two methoxycarbonyl groups are twisted in opposite directions. The plane of the 4-p-tolylgroup in this compound is approximately perpendicular to the 1,4-dihydropyridine ring. In this crystal the molecules of the title compound form centrosymmetric dimers due to the C12–H12⋯O2 hydrogen bond (H⋯C = 2.718 Å, C–H⋯O = 126.29°). These dimers furthermore generate infinite chains via weak C(17)–H(17)⋯O4 (H⋯O = 2.675 Å, C–H⋯O = 150.39°) and C5–H5⋯O4 (H⋯O = 2.508 Å, C–H⋯O = 156.46°) intermolecular hydrogen bonds. The bond lengths and bond angles of the crystal structure are within a reasonable range. 11 – 17

Corresponding authors: Haixia Wu, College of Chemical and Pharmaceutical Engineering, Hebei University of Science and Technology, #26 Yuxiang Street, Yuhua District, Shijiazhuang, 050018, China, E-mail: ; and Jingyu He, College of Chemical Engineering, Shijiazhaung University, Shijiazhuang, 050035, China; and Shijiazhuang Key Laboratory of Target Drug Research and Pharmacodynamic Evaluation, Shijiazhuang, 050035, China, E-mail:

Funding source: Shijiazhuang Key Laboratory of Target Drug Research and Pharmacodynamic Evaluation

  1. Author contribution: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.

  2. Research funding: This work was supported by Shijiazhuang Key Laboratory of Target Drug Research and Pharmacodynamic Evaluation.

  3. Conflict of interest statement: The authors declare no conflicts of interest regarding this article.

References

1. Bruker. APEX2, SAINT; Bruker AXS Inc.: Madison, Wisconsin, USA, 2006.Suche in Google Scholar

2. Bruker. SHELETL; Bruker AXS Inc.: Madison, Wisconsin, USA, 2008.Suche in Google Scholar

3. Sheldrick, G. M. SHELXTL – Integrated Space-Group and Crystal-Structure Determination. Acta Crystallogr. 2015, A71, 3–8.10.1107/S2053273314026370Suche in Google Scholar PubMed PubMed Central

4. Sheldrick, G. M. Crystal Structure Refinement with SHELXL. Acta Crystallogr. 2015, C71, 3–8. https://doi.org/10.1107/s2053229614024218.Suche in Google Scholar

5. Sun, Y. Two New Synthesis Methods of 1, 4-Dihydropyridine; Kunming University of Science and Technology: Kunming, China, 2023.Suche in Google Scholar

6. Shi, D.; Mou, J.; Zhuang, Q. One-Step Synthesis of 4-Aryl-1, 4-Dihydropyridine Derivatives in Aqueous Solutions. Org. Chem. 2004, 09, 1042–1044. https://doi.org/10.3321/j.issn:0253–2786.2004.09.007.Suche in Google Scholar

7. Farahnaz, K.; Banafsheh, Y. Iron(III) Phosphate Catalyzed Synthesis of 1,4-Dihydropyridines. Arab. J. Chem. 2019, 12, 1357–1359. https://doi.org/10.1016/j.arabjc.2014.11.027.Suche in Google Scholar

8. Esfahani, M.-N.; Hoseini, S. J.; Montazerozohori, M. Magnetic Fe3O4 Nanoparticles: Efficient and Recoverable Nanocatalyst for the Synthesis of Polyhydroquinolines and Hantzsch 1,4-Dihydropyridines Under Solvent-Free Conditions. J. Mol. Catal. A: Chem. 2014, 382, 99–105. https://doi.org/10.1016/j.molcata.2013.11.010.Suche in Google Scholar

9. Vohra, R.-K.; Bruneau, C.; Renaud, J.-L. Lewis Acid-Catalyzed Sequential Transformations: Straightforward Preparation of Functional Dihydropyridines. Adv. Synth. Catal. 2006, 348, 2571–2574. https://doi.org/10.1002/adsc.200600343.Suche in Google Scholar

10. Jiang, L.; Ye, W.; Weike, S.; Chuanming, Y. Application of Enzymatic Promiscuity in Pharmaceutical Synthesis: Papain-Catalyzed One-Pot Synthesis of 1,4-Dihydropyridine Calcium Channel Antagonists and Derivatives. Chem. Res. Chin. Univ. 2019, 35, 21–25. https://doi.org/10.1007/s40242-019-8273-8.Suche in Google Scholar

11. Hempel, A.; Gupta, M. P. Diethyl 2,6-Dimethyl-4-Phenyl-1,4-Dihydro-3,5-Pyridinedicarboxylate. Acta Crystallogr. 1978, B34, 3815–3817. https://doi.org/10.1107/s0567740878012327.Suche in Google Scholar

12. Ethiraj, J.; Ajin, R.; Sankaranarayanan, R. K.; Sekar, R.; Veeman, D.; Nanjan, M. J.; Varghese, J. J. Crystallographic and Computational Investigations of Structural Properties in Phenyl and Methoxy-Phenyl Substituted 1,4 Dihydropyridine Derivatives. J. Mol. Struct. 2022, 1254, 132378. https://doi.org/10.1016/j.molstruc.2022.132378.Suche in Google Scholar

13. Hilgeroth, A.; Baumeister, U.; Heinemann, F. W. Topochemical Investigations of Dimerizing 4-Aryl-1,4-Dihydropyridines by X-Ray Crystal Structure Analysis. J. Mol. Struct. 1999, 474, 267–274. https://doi.org/10.1016/s0022-2860(98)00579-1.Suche in Google Scholar

14. Goba, I.; Turovska, B.; Belyakov, S.; Liepinsh, E. Synthesis, Spectroscopic and Conformational Analysis of 1,4-Dihydroisonicotinic Acid Derivatives. J. Mol. Struct. 2014, 1074, 549–558. https://doi.org/10.1016/j.molstruc.2014.06.044.Suche in Google Scholar

15. Morales-Rios, M. S.; Martinez-Richa, A.; Hernandez-Gallegos, Z.; Hernandez-Barragan, A.; Vera-Graziano, R.; Joseph-Nathan, P. Studies of Dihydropyridines by X-Ray Diffraction and Solid State 13C NMR. Z. Naturforsch., B: Chem. Sci. 2007, 63, 549–555. https://doi.org/10.1515/znb-2007-0410.Suche in Google Scholar

16. Fossheim, R.; Svarteng, K.; Mostad, A.; Romming, C.; Shefter, E.; Triggle, D. J. Crystal Structures and Pharmacological Activity of Calcium Channel Antagonists: 2,6-Dimethyl-3,5-Dicarbomethoxy-4-(Unsubstituted, 3-Methyl-4-Methyl-3-Nitro-4-Nitro-and 2,4-Dinitrophenyl)-L,4-Dihydropyridine. J. Med. Chem. 1982, 25, 126–131. https://doi.org/10.1021/jm00344a007.Suche in Google Scholar PubMed

17. Asahara, H.; Hamada, M.; Nakaike, Y.; Nishiwaki, N. Construction of 3,5-Dinitrated 1,4-Dihydropyridines Modifiable at 1,4-Positions by a Reaction of β-Formyl-β-Nitroenamines with Aldehydes. RSC Adv. 2015, 5, 90778–90784. https://doi.org/10.1039/c5ra19439c.Suche in Google Scholar
Received: 2024-04-13
Accepted: 2024-05-30
Published Online: 2024-06-18
Published in Print: 2024-08-27

© 2024 the author(s), published by De Gruyter, Berlin/Boston

This work is licensed under the Creative Commons Attribution 4.0 International License.

Artikel in diesem Heft

  1. Frontmatter
  2. New Crystal Structures
  3. The crystal structure of hexaquazinc(II) poly[hexakis(μ2-4-methylbenzenesulfinato-κ2O:O′) dizinc(II)]
  4. The crystal structure of poly[((2-(4,5-dihydro-1H-pyrazol-4-yl)-1,3-dioxoisoindoline-5-carbonyl)oxy)(1-(dimethylamino)ethoxy)zinc[II]], C16H14ZnN4O5
  5. Crystal structure of bis[(triaqua-4-iodopyridine-2,6-dicarboxylato-κ 3 N,O,O ″)cobalt(II)] trihydrate, C14H22N2O17I2Co2
  6. Crystal structure of bis(methanol-κO)-bis(nitrato-kO)-bis(1-((2-(2-chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole-κN)cadmium(II), C40H42O14N8Cl4Cd
  7. Crystal structure of poly[μ2-dichlorido-(μ2-1-[(2,4-dimethyl-1H-triazole-1-yl)methyl]-1H-benzotriazole-κ2N:N′)cadmium(II)], C11H12CdN6Cl2
  8. The crystal structure of (3aS, 4R, 7S, 7aR)-hexahydro-4, 7-methano-1H-isoindole-1, 3-(2H)-dione, C9H11NO2
  9. The crystal structure of N-(acridin-9-yl)-4-chloro-N-(4-chloro-butanoyl) butanamide, C21H20Cl2N2O2
  10. Crystal structure of 3,3′-dimethoxy-4,4′-oxy-di-benzaldehyde, C16H14O5
  11. The crystal structure of tetrakis(μ 2-2-amino-3,5-dibromobenzoate-κ 2 O:O′)-octakis(n-butyl-κ 1 C)-bis(μ 3-oxo)tetratin(II), C60H92Br8N4O10Sn4
  12. Crystal structure of methyl-1-(naphthalen-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b] indole-3-carboxylate, C23H20N2O2
  13. Crystal structure of tetrapropylammonium bicarbonate–1-(diaminomethylene)thiourea(1/1)
  14. Crystal structure of 6,6′-((1E,1′E)-((2-phenylpyrimidine-4,6-diyl)bis(hydrazin-2-yl-1-ylidene))bis(methaneylylidene))bis(2-methoxyphenol)monohydrate, C26H26N6O5
  15. Crystal structure of bis(N,N,N-trimethylbutanaminium) tetrathiotungstate(VI), (BuMe3N)2[WS4]
  16. The crystal structure of 2,3,9-triphenyl-9-(2-phenylbenzofuran-3-yl)-9H-9λ 5-benzo[4,5][1,2]oxaphospholo[2,3-b][1,2,5]oxadiphosphole 2-oxide, C40H28O4P2
  17. Crystal structure of 1–methyl-3-propyl-4-nitro-1H-pyrazole-5-carboxylic acid, C8H11N3O4
  18. Crystal structure of N-(benzo[d]thiazol-2-yl)-2-chloroacetamide, C9H7ClN2OS
  19. The crystal structure of N-benzyl-2-chloro-N-(p-tolyl) acetamide, C16H16ClNO
  20. Crystal structure of 3,4-dimethoxybenzyl 2-(6-methoxynaphthalen-2-yl)propanoate, C23H24O5
  21. Crystal structure of 2,5-bis(2,5-dimethoxybenzyl)-3,6-dimethyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione, C26H28N2O6
  22. Crystal structure of poly[(μ3-5-bromoisophthalato-κ4 O,O′ :O″,O‴)-(μ2-1,2-bis(1,2,4-triazole-1-ylmethyl)benzene-κ2 N:N′)cobalt(II)], C20H15BrCoN6O4
  23. The crystal structure of bis(2-(piperidin-1-ium-4-yl)-1Hbenzo[d]imidazol-3-ium) dihydrogen decavanadate, C24H36N6O28V10
  24. Crystal structure of diaqua-bis(1-(3-carboxyphenyl)-5-methyl-4-oxo-1,4-dihydropyridazine3-carboxylato-O,O′)-cobalt(ii)dihydrate, C26H36N4O14Co
  25. Crystal structure of poly[(μ2-5-bromoisophthalato-κ4 O,O ′:O ″,O ‴)-(μ2-1,4-bis(2-methylimidazol-1-ylmethyl)benzene-N:N′)cadmium(II)], C24H21BrCdN4O4
  26. The crystal structure of dimethyl 8-(3-methoxy-2-(methoxycarbonyl)-3-oxoprop-1-en-1-yl)-4-methyl-1-(p-tolyl)-1,3a,4,8b-tetrahydro-3H-furo[3,4-b]indole-3,3-dicarboxylate. C28H29NO9
  27. Crystal structure of (3R)-1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate chloride, C21H23ClN2O4
  28. Synthesis and crystal structure of 3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid, C12H13NO5S
  29. The crystal structure of hexaaquamagnesium(II) bis-3-(1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-α]pyridin-1-yl)benzoate, C36H42N4O10Mg
  30. Crystal structure of 4-formyl-2-methoxyphenyl 2-acetoxybenzoate, C17H14O6
  31. Crystal structure of poly[octakis(μ-oxido)-tris(μ-1,1′-[[1,1′-biphenyl]-4,4′-diylbis(methylene)]bis(1H-imidazole))-tetrakis(oxido)-tetra-vanadium-dimanganese(II)dihydrate], C30H29MnN6O7V2
  32. Crystal structure of 4,8a-bis(4-chlorophenyl)-1,5,6-tris(4-fluorobenzyl)-1,4,4a,4b,5,6,8a,8b-octahydrocyclobuta[1,2-b:3,4-c′]dipyridine-3,8-dicarbonitrile, C45H33Cl2F3N4
  33. Crystal structure of benzo[d][1,3]dioxol-5-ylmethyl 2-(6-methoxynaphthalen-2-yl)propanoate, C22H20O5
  34. Crystal structure of N-benzoyl-N-phenylhydroxylaminato-dicarbonylrhodium(I), [Rh(BNA)CO2]
  35. The crystal structure of N-(2-((2-methoxynaphthalen-1-yl)ethynyl)phenyl)-4-methylbenzenesulfonamide, C26H21NO3S
  36. The crystal structure of methyl ((4-aminobenzyl)sulfonyl)-d-prolinate, C13H18N2O4S
  37. The crystal structure of dichlorido-(N-isopropyl-N-(pyridin-2-ylmethyl)propan-2-amine-κ 2 N, N′)palladium(II), C12H20N2PdCl2
  38. Crystal structure of poly[(μ 2-5-hydroxyisophthalato-κ4 O,O′:O″,O‴)-(μ 2-1,4-bis(2-methylimidazolyl)-1-butene-N:N′)nickel(II)], C20H20NiN4O5
  39. The crystal structure of {hexakis(1-methyl-1H-imidazole-κ 1 N)cobalt(II)}(μ 2-oxido)-hexaoxido-dimolybdenum(VI)— 1-methyl-1H-imidazole (1/2), C32H48CoMo2N16O7
  40. Synthesis, crystal structure and nonlinear optical property of 1-((propan-2-ylideneamino)oxy)propan-2-yl-4-methylbenzenesulfonate, C13H19O4NS
  41. The crystal structure of N,N-(ethane-1,1-diyl)dibenzamide, C16H16N2O2
  42. Crystal structure of 1-(4-bromophenyl)-3-(diphenylphosphoryl)-3-hydroxypropan-1-one, C21H18BrO3P
  43. The crystal structure of fac-tricarbonyl(bis(3,5-dimethyl-4H-pyrazole)-κ1 N)-((nitrato)-κ1 O)-rhenium(I)— 3,5-dimethyl-4H-pyrazole(1/1), C18H23N7O6Re
  44. The crystal structure of 4′-chloro-griseofulvin: (2S,6′R)-4′,7-dichloro-4,6-dimethoxy-6′-methyl-3H-spiro[benzofuran-2,1′-cyclohexan]-3′-ene-2′,3-dione, C16H14Cl2O5
  45. Crystal structure of tetraethylammonium bicarbonate–1-(diaminomethylene)thiourea(1/1)
  46. Crystal structure of 1-cyclohexyl-4-p-tolyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester, C22H27NO4
  47. The crystal structure of catena-poly(μ2-1,4-bis-(1H-imidazol-1-yl)benzene-copper(I)) dichloridocopper(I), {[CuC12H10N4]+[CuCl2]−} n
  48. The crystal structure of propane-1-aminium-2-carbamate, C4H10N2O2
  49. Crystal structure of 5,6,3′,4′,5′-pentamethoxy-flavone dihydrate, C20H24O9
  50. Crystal structure of (E)-N-(2-bromophenyl)-4-(4-(3,5-dimethoxystyryl)phenoxy)pyrimidin-2-amine, C26H22BrN3O3
  51. Crystal structure of methyl (3R)-1-(2-bromo-4-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate hydrochloride hydrate, C19H19BrClFN2O3
  52. The crystal structure of 1-(2-chlorophenyl)-3-(p-tolyl)urea, C14H13ClN2O
  53. The crystal structure of 1-cyclohexyl-3-(p-tolyl)urea, C14H20N2O
  54. Crystal structure of ((benzyl(hydroxy)-amino)(4-chlorophenyl)methyl)-diphenylphosphine oxide, C26H23ClNO2P
  55. The crystal structure of ethyl 3-(1-methyl-1H-indole-2-carbonyl)-2-phenylquinoline-4-carboxylate, C28H22N2O3
  56. The crystal structure of 1,4-bis(1H-imidazol-3-ium-1-yl)benzene dinitrate, C12H12N4 2+·2(NO3 −)
  57. Crystal structure of tris(hexafluoroacetylacetonato-κ2O,O′) bis(triphenylphosphine oxide-κ1O)samarium(III), C51H33F18O8P2Sm
  58. Crystal structure of 1-(4-(dimethylamino)phenyl)-2,3-bis(diphenylphosphoryl)propan-1-one, C35H33NO3P2
  59. Crystal structure of diaqua[bis(μ 2-pyridine 2,6-dicarboxylato) bismuth(III) potassium(I)], C14H10BiKN2O10
  60. Crystal structure of (R)-N, N ′-dimethyl-[1, 1′-binaphthalene]-2, 2′-diamine, C22H20N2
  61. Crystal structure of 1-phenyl-4-(2-furoyl)-3-furyl-1H-pyrazol-5-ol, C18H12N2O4
  62. Crystal structure of bis(14,34-dimethyl[11,21:23,31-terphenyl]-22-yl)diselane, C40H34Se2
https://doi.org/10.1515/ncrs-2024-0171
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Artikel in diesem Heft

  1. Frontmatter
  2. New Crystal Structures
  3. The crystal structure of hexaquazinc(II) poly[hexakis(μ2-4-methylbenzenesulfinato-κ2O:O′) dizinc(II)]
  4. The crystal structure of poly[((2-(4,5-dihydro-1H-pyrazol-4-yl)-1,3-dioxoisoindoline-5-carbonyl)oxy)(1-(dimethylamino)ethoxy)zinc[II]], C16H14ZnN4O5
  5. Crystal structure of bis[(triaqua-4-iodopyridine-2,6-dicarboxylato-κ 3 N,O,O ″)cobalt(II)] trihydrate, C14H22N2O17I2Co2
  6. Crystal structure of bis(methanol-κO)-bis(nitrato-kO)-bis(1-((2-(2-chloro-4-(4-chlorophenoxy)phenyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole-κN)cadmium(II), C40H42O14N8Cl4Cd
  7. Crystal structure of poly[μ2-dichlorido-(μ2-1-[(2,4-dimethyl-1H-triazole-1-yl)methyl]-1H-benzotriazole-κ2N:N′)cadmium(II)], C11H12CdN6Cl2
  8. The crystal structure of (3aS, 4R, 7S, 7aR)-hexahydro-4, 7-methano-1H-isoindole-1, 3-(2H)-dione, C9H11NO2
  9. The crystal structure of N-(acridin-9-yl)-4-chloro-N-(4-chloro-butanoyl) butanamide, C21H20Cl2N2O2
  10. Crystal structure of 3,3′-dimethoxy-4,4′-oxy-di-benzaldehyde, C16H14O5
  11. The crystal structure of tetrakis(μ 2-2-amino-3,5-dibromobenzoate-κ 2 O:O′)-octakis(n-butyl-κ 1 C)-bis(μ 3-oxo)tetratin(II), C60H92Br8N4O10Sn4
  12. Crystal structure of methyl-1-(naphthalen-1-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b] indole-3-carboxylate, C23H20N2O2
  13. Crystal structure of tetrapropylammonium bicarbonate–1-(diaminomethylene)thiourea(1/1)
  14. Crystal structure of 6,6′-((1E,1′E)-((2-phenylpyrimidine-4,6-diyl)bis(hydrazin-2-yl-1-ylidene))bis(methaneylylidene))bis(2-methoxyphenol)monohydrate, C26H26N6O5
  15. Crystal structure of bis(N,N,N-trimethylbutanaminium) tetrathiotungstate(VI), (BuMe3N)2[WS4]
  16. The crystal structure of 2,3,9-triphenyl-9-(2-phenylbenzofuran-3-yl)-9H-9λ 5-benzo[4,5][1,2]oxaphospholo[2,3-b][1,2,5]oxadiphosphole 2-oxide, C40H28O4P2
  17. Crystal structure of 1–methyl-3-propyl-4-nitro-1H-pyrazole-5-carboxylic acid, C8H11N3O4
  18. Crystal structure of N-(benzo[d]thiazol-2-yl)-2-chloroacetamide, C9H7ClN2OS
  19. The crystal structure of N-benzyl-2-chloro-N-(p-tolyl) acetamide, C16H16ClNO
  20. Crystal structure of 3,4-dimethoxybenzyl 2-(6-methoxynaphthalen-2-yl)propanoate, C23H24O5
  21. Crystal structure of 2,5-bis(2,5-dimethoxybenzyl)-3,6-dimethyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione, C26H28N2O6
  22. Crystal structure of poly[(μ3-5-bromoisophthalato-κ4 O,O′ :O″,O‴)-(μ2-1,2-bis(1,2,4-triazole-1-ylmethyl)benzene-κ2 N:N′)cobalt(II)], C20H15BrCoN6O4
  23. The crystal structure of bis(2-(piperidin-1-ium-4-yl)-1Hbenzo[d]imidazol-3-ium) dihydrogen decavanadate, C24H36N6O28V10
  24. Crystal structure of diaqua-bis(1-(3-carboxyphenyl)-5-methyl-4-oxo-1,4-dihydropyridazine3-carboxylato-O,O′)-cobalt(ii)dihydrate, C26H36N4O14Co
  25. Crystal structure of poly[(μ2-5-bromoisophthalato-κ4 O,O ′:O ″,O ‴)-(μ2-1,4-bis(2-methylimidazol-1-ylmethyl)benzene-N:N′)cadmium(II)], C24H21BrCdN4O4
  26. The crystal structure of dimethyl 8-(3-methoxy-2-(methoxycarbonyl)-3-oxoprop-1-en-1-yl)-4-methyl-1-(p-tolyl)-1,3a,4,8b-tetrahydro-3H-furo[3,4-b]indole-3,3-dicarboxylate. C28H29NO9
  27. Crystal structure of (3R)-1-(3,5-dimethoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate chloride, C21H23ClN2O4
  28. Synthesis and crystal structure of 3-(4,5-dihydroisoxazol-3-yl)-2-methyl-4-(methylsulfonyl)benzoic acid, C12H13NO5S
  29. The crystal structure of hexaaquamagnesium(II) bis-3-(1,2,3,4-tetrahydrobenzo[4,5]imidazo[1,2-α]pyridin-1-yl)benzoate, C36H42N4O10Mg
  30. Crystal structure of 4-formyl-2-methoxyphenyl 2-acetoxybenzoate, C17H14O6
  31. Crystal structure of poly[octakis(μ-oxido)-tris(μ-1,1′-[[1,1′-biphenyl]-4,4′-diylbis(methylene)]bis(1H-imidazole))-tetrakis(oxido)-tetra-vanadium-dimanganese(II)dihydrate], C30H29MnN6O7V2
  32. Crystal structure of 4,8a-bis(4-chlorophenyl)-1,5,6-tris(4-fluorobenzyl)-1,4,4a,4b,5,6,8a,8b-octahydrocyclobuta[1,2-b:3,4-c′]dipyridine-3,8-dicarbonitrile, C45H33Cl2F3N4
  33. Crystal structure of benzo[d][1,3]dioxol-5-ylmethyl 2-(6-methoxynaphthalen-2-yl)propanoate, C22H20O5
  34. Crystal structure of N-benzoyl-N-phenylhydroxylaminato-dicarbonylrhodium(I), [Rh(BNA)CO2]
  35. The crystal structure of N-(2-((2-methoxynaphthalen-1-yl)ethynyl)phenyl)-4-methylbenzenesulfonamide, C26H21NO3S
  36. The crystal structure of methyl ((4-aminobenzyl)sulfonyl)-d-prolinate, C13H18N2O4S
  37. The crystal structure of dichlorido-(N-isopropyl-N-(pyridin-2-ylmethyl)propan-2-amine-κ 2 N, N′)palladium(II), C12H20N2PdCl2
  38. Crystal structure of poly[(μ 2-5-hydroxyisophthalato-κ4 O,O′:O″,O‴)-(μ 2-1,4-bis(2-methylimidazolyl)-1-butene-N:N′)nickel(II)], C20H20NiN4O5
  39. The crystal structure of {hexakis(1-methyl-1H-imidazole-κ 1 N)cobalt(II)}(μ 2-oxido)-hexaoxido-dimolybdenum(VI)— 1-methyl-1H-imidazole (1/2), C32H48CoMo2N16O7
  40. Synthesis, crystal structure and nonlinear optical property of 1-((propan-2-ylideneamino)oxy)propan-2-yl-4-methylbenzenesulfonate, C13H19O4NS
  41. The crystal structure of N,N-(ethane-1,1-diyl)dibenzamide, C16H16N2O2
  42. Crystal structure of 1-(4-bromophenyl)-3-(diphenylphosphoryl)-3-hydroxypropan-1-one, C21H18BrO3P
  43. The crystal structure of fac-tricarbonyl(bis(3,5-dimethyl-4H-pyrazole)-κ1 N)-((nitrato)-κ1 O)-rhenium(I)— 3,5-dimethyl-4H-pyrazole(1/1), C18H23N7O6Re
  44. The crystal structure of 4′-chloro-griseofulvin: (2S,6′R)-4′,7-dichloro-4,6-dimethoxy-6′-methyl-3H-spiro[benzofuran-2,1′-cyclohexan]-3′-ene-2′,3-dione, C16H14Cl2O5
  45. Crystal structure of tetraethylammonium bicarbonate–1-(diaminomethylene)thiourea(1/1)
  46. Crystal structure of 1-cyclohexyl-4-p-tolyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester, C22H27NO4
  47. The crystal structure of catena-poly(μ2-1,4-bis-(1H-imidazol-1-yl)benzene-copper(I)) dichloridocopper(I), {[CuC12H10N4]+[CuCl2]−} n
  48. The crystal structure of propane-1-aminium-2-carbamate, C4H10N2O2
  49. Crystal structure of 5,6,3′,4′,5′-pentamethoxy-flavone dihydrate, C20H24O9
  50. Crystal structure of (E)-N-(2-bromophenyl)-4-(4-(3,5-dimethoxystyryl)phenoxy)pyrimidin-2-amine, C26H22BrN3O3
  51. Crystal structure of methyl (3R)-1-(2-bromo-4-fluorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate hydrochloride hydrate, C19H19BrClFN2O3
  52. The crystal structure of 1-(2-chlorophenyl)-3-(p-tolyl)urea, C14H13ClN2O
  53. The crystal structure of 1-cyclohexyl-3-(p-tolyl)urea, C14H20N2O
  54. Crystal structure of ((benzyl(hydroxy)-amino)(4-chlorophenyl)methyl)-diphenylphosphine oxide, C26H23ClNO2P
  55. The crystal structure of ethyl 3-(1-methyl-1H-indole-2-carbonyl)-2-phenylquinoline-4-carboxylate, C28H22N2O3
  56. The crystal structure of 1,4-bis(1H-imidazol-3-ium-1-yl)benzene dinitrate, C12H12N4 2+·2(NO3 −)
  57. Crystal structure of tris(hexafluoroacetylacetonato-κ2O,O′) bis(triphenylphosphine oxide-κ1O)samarium(III), C51H33F18O8P2Sm
  58. Crystal structure of 1-(4-(dimethylamino)phenyl)-2,3-bis(diphenylphosphoryl)propan-1-one, C35H33NO3P2
  59. Crystal structure of diaqua[bis(μ 2-pyridine 2,6-dicarboxylato) bismuth(III) potassium(I)], C14H10BiKN2O10
  60. Crystal structure of (R)-N, N ′-dimethyl-[1, 1′-binaphthalene]-2, 2′-diamine, C22H20N2
  61. Crystal structure of 1-phenyl-4-(2-furoyl)-3-furyl-1H-pyrazol-5-ol, C18H12N2O4
  62. Crystal structure of bis(14,34-dimethyl[11,21:23,31-terphenyl]-22-yl)diselane, C40H34Se2
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© 2025 De Gruyter Brill
Heruntergeladen am 23.9.2025 von https://www.degruyterbrill.com/document/doi/10.1515/ncrs-2024-0171/html
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