555 related articles for article (PubMed ID: 19767686)
1. Structure and conformational analysis of a bidentate pro-ligand, C21H34N2S2, from powder synchrotron diffraction data and solid-state DFTB calculations.
Avila EE; Mora AJ; Delgado GE; Contreras RR; Rincón L; Fitch AN; Brunelli M
Acta Crystallogr B; 2009 Oct; 65(Pt 5):639-46. PubMed ID: 19767686
[TBL] [Abstract][Full Text] [Related]
2. Molecular and crystalline structure of cycloheptanespiro-3'(4'H)-6',7',8',9'-tetrahydrocyclohexa[b][1,4]thiazole-2'(5'H)-thione from powder synchrotron X-ray diffraction data.
Avila EE; Mora AJ; Delgado GE; Contreras RR; Fitch AN; Brunelli M
Acta Crystallogr B; 2008 Apr; 64(Pt 2):217-22. PubMed ID: 18369293
[TBL] [Abstract][Full Text] [Related]
3. Molecular and crystalline structures of three (S)-4-alkoxycarbonyl-2-azetidinones containing long alkyl side chains from synchrotron X-ray powder diffraction data.
Seijas LE; Mora AJ; Delgado GE; López-Carrasquero F; Báez ME; Brunelli M; Fitch AN
Acta Crystallogr B; 2009 Dec; 65(Pt 6):724-30. PubMed ID: 19923701
[TBL] [Abstract][Full Text] [Related]
4. Intra- and intermolecular interactions in small bioactive molecules: cooperative features from experimental and theoretical charge-density analysis.
Munshi P; Guru Row TN
Acta Crystallogr B; 2006 Aug; 62(Pt 4):612-26. PubMed ID: 16840811
[TBL] [Abstract][Full Text] [Related]
5. Structure of Ca(BD4)2 beta-phase from combined neutron and synchrotron X-ray powder diffraction data and density functional calculations.
Buchter F; Łodziana Z; Remhof A; Friedrichs O; Borgschulte A; Mauron P; Züttel A; Sheptyakov D; Barkhordarian G; Bormann R; Chłopek K; Fichtner M; Sørby M; Riktor M; Hauback B; Orimo S
J Phys Chem B; 2008 Jul; 112(27):8042-8. PubMed ID: 18553898
[TBL] [Abstract][Full Text] [Related]
6. Characterizing challenging microcrystalline solids with solid-state NMR shift tensor and synchrotron X-ray powder diffraction data: structural analysis of ambuic acid.
Harper JK; Grant DM; Zhang Y; Lee PL; Von Dreele R
J Am Chem Soc; 2006 Feb; 128(5):1547-52. PubMed ID: 16448125
[TBL] [Abstract][Full Text] [Related]
7. 3,5-diphenyl-1,2,4-triazin-6(1H)-one: synthesis, and X-ray and DFT-calculated structures.
Ejsmont K; Kudelko A; Zieliński W
Acta Crystallogr C; 2012 Apr; 68(Pt 4):o149-51. PubMed ID: 22476145
[TBL] [Abstract][Full Text] [Related]
8. Ezetimibe anhydrate, determined from laboratory powder diffraction data.
Brüning J; Alig E; Schmidt MU
Acta Crystallogr C; 2010 Jul; 66(Pt 7):o341-4. PubMed ID: 20603561
[TBL] [Abstract][Full Text] [Related]
9. Van der Waals versus hydrogen-bonding forces in a crystalline analog of cellotetraose: cyclohexyl 4'-O-cyclohexyl beta-D-cellobioside cyclohexane solvate.
Yoneda Y; Mereiter K; Jaeger C; Brecker L; Kosma P; Rosenau T; French A
J Am Chem Soc; 2008 Dec; 130(49):16678-90. PubMed ID: 19554694
[TBL] [Abstract][Full Text] [Related]
10. Solid state structure and absolute configuration of filifolinol acetate.
Muñoz MA; Urzúa A; Echeverría J; Modak B; Joseph-Nathan P
Nat Prod Commun; 2011 Jun; 6(6):759-62. PubMed ID: 21815405
[TBL] [Abstract][Full Text] [Related]
11. Structure of N-(5-ethyl-[1,3,4]-thiadiazole-2-yl)toluenesulfonamide by combined X-ray powder diffraction, 13C solid-state NMR and molecular modelling.
Hangan A; Borodi G; Filip X; Tripon C; Morari C; Oprean L; Filip C
Acta Crystallogr B; 2010 Dec; 66(Pt 6):615-21. PubMed ID: 21099024
[TBL] [Abstract][Full Text] [Related]
12. (E)-2-[(4-chlorophenyl)iminomethyl]-5-methoxyphenol and (E)-2-[(2-chlorophenyl)iminomethyl]-5-methoxyphenol: X-ray and DFT-calculated structures.
Koşar B; Albayrak C; Odabaşoğlu M; Büyükgüngör O
Acta Crystallogr C; 2009 Oct; 65(Pt 10):o517-20. PubMed ID: 19805885
[TBL] [Abstract][Full Text] [Related]
13. Ab initio structure determination of 5-anilinomethylene-2,2-dimethyl-1,3-dioxane-4,6-dione from laboratory powder data--a combined use of X-ray, molecular and solid-state DFT study.
Smrcok L; Jorík V; Scholtzová E; Milata V
Acta Crystallogr B; 2007 Jun; 63(Pt 3):477-84. PubMed ID: 17507761
[TBL] [Abstract][Full Text] [Related]
14. Enhanced efficiency of direct-space structure solution from powder X-ray diffraction data in the case of conformationally flexible molecules.
Hanson AJ; Cheung EY; Harris KD
J Phys Chem B; 2007 Jun; 111(23):6349-56. PubMed ID: 17516675
[TBL] [Abstract][Full Text] [Related]
15. (13)C CP MAS NMR and crystal structure of methyl glycopyranosides.
Paradowska K; Gubica T; Temeriusz A; Cyrański MK; Wawer I
Carbohydr Res; 2008 Sep; 343(13):2299-307. PubMed ID: 18547551
[TBL] [Abstract][Full Text] [Related]
16. Competing intermolecular interactions in the high-temperature solid phases of even saturated carboxylic acids (C10H19O2H to C20H39O2H).
Moreno-Calvo E; Gbabode G; Cordobilla R; Calvet T; Cuevas-Diarte MA; Negrier P; Mondieig D
Chemistry; 2009 Dec; 15(47):13141-9. PubMed ID: 19862782
[TBL] [Abstract][Full Text] [Related]
17. Four N(7)-benzyl-substituted 4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridine-5-spiro-1'-cyclohexane-2',6'-diones as ethanol hemisolvates: similar molecular constitutions but different crystal structures.
Cruz S; Trilleras J; Cobo J; Low JN; Glidewell C
Acta Crystallogr C; 2008 Dec; 64(Pt 12):o637-42. PubMed ID: 19057075
[TBL] [Abstract][Full Text] [Related]
18. Crystal structure and hydrogen bonding system in cellulose I(alpha) from synchrotron X-ray and neutron fiber diffraction.
Nishiyama Y; Sugiyama J; Chanzy H; Langan P
J Am Chem Soc; 2003 Nov; 125(47):14300-6. PubMed ID: 14624578
[TBL] [Abstract][Full Text] [Related]
19. Improper hydrogen bonded cyclohexane C-Hax···Yax contacts: theoretical predictions and experimental evidence from 1H NMR spectroscopy of suitable axial cyclohexane models.
Kolocouris A; Zervos N; De Proft F; Koch A
J Org Chem; 2011 Jun; 76(11):4432-43. PubMed ID: 21486092
[TBL] [Abstract][Full Text] [Related]
20. Spectroscopic investigations and crystal structure from synchrotron powder data of the inclusion complex of beta-cyclodextrin with atenolol.
Borodi G; Bratu I; Dragan F; Peschar R; Helmholdt RB; Hernanz A
Spectrochim Acta A Mol Biomol Spectrosc; 2008 Oct; 70(5):1041-8. PubMed ID: 18061532
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
