247 related articles for article (PubMed ID: 24486864)
1. The structures of heterocyclic complexes ruled by hydrogen bonds and halogen interactions: interaction strength and IR modes.
Oliveira BG
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():208-15. PubMed ID: 24486864
[TBL] [Abstract][Full Text] [Related]
2. The significant role of the intermolecular CH⋯O/N hydrogen bonds in governing the biologically important pairs of the DNA and RNA modified bases: a comprehensive theoretical investigation.
Brovarets' OO; Yurenko YP; Hovorun DM
J Biomol Struct Dyn; 2015; 33(8):1624-52. PubMed ID: 25350312
[TBL] [Abstract][Full Text] [Related]
3. The electronic donation and frequency shifts on the YCCH⋯BH₄⁻ boron-bonded complexes (Y=H, CH₃, CF₃ and CCl₃).
Pordeus RQ; Rego DG; Oliveira BG
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jun; 145():580-587. PubMed ID: 25812944
[TBL] [Abstract][Full Text] [Related]
4. A quantum chemical study of the structures, stability, and spectroscopy of halogen- and hydrogen-boned complexes between cyanoacetaldehyde and hypochlorous acids.
Tang Q; Guo Z; Li Q
Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():157-63. PubMed ID: 24239758
[TBL] [Abstract][Full Text] [Related]
5. MP2, density functional theory, and molecular mechanical calculations of C-H...pi and hydrogen bond interactions in a cellulose-binding module-cellulose model system.
Mohamed MN; Watts HD; Guo J; Catchmark JM; Kubicki JD
Carbohydr Res; 2010 Aug; 345(12):1741-51. PubMed ID: 20580346
[TBL] [Abstract][Full Text] [Related]
6. New insights about the hydrogen bonds formed between acetylene and hydrogen fluoride: π⋯H, C⋯H and F⋯H.
Silva DS; Oliveira BG
Spectrochim Acta A Mol Biomol Spectrosc; 2017 Feb; 173():160-169. PubMed ID: 27636326
[TBL] [Abstract][Full Text] [Related]
7. A structure-based analysis of the vibrational spectra of nitrosyl ligands in transition-metal coordination complexes and clusters.
De La Cruz C; Sheppard N
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jan; 78(1):7-28. PubMed ID: 21123107
[TBL] [Abstract][Full Text] [Related]
8. Experimental and DFT studies on the vibrational and electronic spectra and NBO analysis of 2-amino-3-((E)-(9-p-tolyl-9H-carbazol-3-yl) methyleneamino) maleonitrile.
Meng N; Zhang Y; Wang Y; Ma K; Zhao J; Tang G
Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():494-507. PubMed ID: 24291425
[TBL] [Abstract][Full Text] [Related]
9. Intermolecular charge flux as the origin of infrared intensity enhancement upon halogen-bond formation of the peptide group.
Torii H
J Chem Phys; 2010 Jul; 133(3):034504. PubMed ID: 20649334
[TBL] [Abstract][Full Text] [Related]
10. Ab initio investigation of the complexes between bromobenzene and several electron donors: some insights into the magnitude and nature of halogen bonding interactions.
Lu YX; Zou JW; Wang YH; Jiang YJ; Yu QS
J Phys Chem A; 2007 Oct; 111(42):10781-8. PubMed ID: 17918810
[TBL] [Abstract][Full Text] [Related]
11. Cationic P⋯N interaction in XH3P(+)⋯NCY complexes (X=H, F, CN, NH2, OH; Y=H, Li, F, Cl) and its cooperativity with hydrogen/lithium/halogen bond.
Esrafili MD; Asadollahi S
J Mol Graph Model; 2016 Mar; 64():131-138. PubMed ID: 26851863
[TBL] [Abstract][Full Text] [Related]
12. Hydrogen bonds determine the structures of the ternary heterocyclic complexes C₂H₄O···2HF, C₂H₅N···2HF and C₂H₄S···2HF: density functional theory and topological calculations.
Oliveira BG; Araújo RC; Carvalho AB; Ramos MN
J Mol Model; 2011 Nov; 17(11):2847-62. PubMed ID: 21301908
[TBL] [Abstract][Full Text] [Related]
13. Intermolecular CH···O/N H-bonds in the biologically important pairs of natural nucleobases: a thorough quantum-chemical study.
Brovarets' OO; Yurenko YP; Hovorun DM
J Biomol Struct Dyn; 2014; 32(6):993-1022. PubMed ID: 23730732
[TBL] [Abstract][Full Text] [Related]
14. Bond paths show preferable interactions: ab initio and QTAIM studies on the X-H...pi hydrogen bond.
Grabowski SJ; Ugalde JM
J Phys Chem A; 2010 Jul; 114(26):7223-9. PubMed ID: 20533848
[TBL] [Abstract][Full Text] [Related]
15. Red- and blue-shifted hydrogen bonds: the Bent rule from quantum theory of atoms in molecules perspective.
Grabowski SJ
J Phys Chem A; 2011 Nov; 115(45):12789-99. PubMed ID: 21830803
[TBL] [Abstract][Full Text] [Related]
16. Structure, energy, vibrational spectrum, and Bader's analysis of π···H hydrogen bonds and H(-δ)···H(+δ) dihydrogen bonds.
de Oliveira BG
Phys Chem Chem Phys; 2013 Jan; 15(1):37-79. PubMed ID: 23138158
[TBL] [Abstract][Full Text] [Related]
17. A theoretical study of nonlinearity in heterocyclic hydrogen-bonded complexes.
Oliveira BG; Duarte EM; Araújo RC; Ramos MN; Carvalho AB
Spectrochim Acta A Mol Biomol Spectrosc; 2005 Jan; 61(3):491-4. PubMed ID: 15582817
[TBL] [Abstract][Full Text] [Related]
18. Halogen as halogen-bonding donor and hydrogen-bonding acceptor simultaneously in ring-shaped H3N·X(Y)·HF (X = Cl, Br and Y = F, Cl, Br) complexes.
Zhou PP; Qiu WY; Liu S; Jin NZ
Phys Chem Chem Phys; 2011 Apr; 13(16):7408-18. PubMed ID: 21423995
[TBL] [Abstract][Full Text] [Related]
19. The interplay and strength of the π⋯HF, C⋯HF, F⋯HF and F⋯HC hydrogen bonds upon the formation of multimolecular complexes based on C
Carvalho LC; Bueno MA; de Oliveira BG
Spectrochim Acta A Mol Biomol Spectrosc; 2019 Apr; 213():438-455. PubMed ID: 30738351
[TBL] [Abstract][Full Text] [Related]
20. Hydrogen bond strengthening of cis-trans glyoxal dimers in electronic excited states: a theoretical study.
Poorabdollah H; Omidyan R; Solimannejad M; Azimi G
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Mar; 122():337-42. PubMed ID: 24317260
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
