C-H...O HYDROGEN BONDING
(Benzoylmethyl)triphenylphosphonium iodide: supramolecular zigzag chains via C—H⋯O hydrogen bonding stabilized by C—H⋯I interactions
... parameters in (I) resemble those of the isomorphous nitrate salt (Pbca with Z = 8; Baby Mariyatra et al., 2002), but differ from the parent ylide (Kalyanasundari et al., 1994). The crystal structure can be best described ...
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Weak C—H⋯O hydrogen bonding and aromatic π–π stacking interactions in 1 (4 chlorophenyl)propan 1 one
... The short c axis [3.945 (4) AÊ] for a disubstituted benzene molecule suggests face-to-face intermolecular ±-stacking interactions. Mean-plane calculations for the aromatic rings stacked along the c axis ...
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Crystal structures of trans acetyldicarbonyl(η5 cyclopentadienyl)(dimethylphenylphosphane)molybdenum(II) and trans acetyldicarbonyl(η5 cyclopentadienyl)(ethyldiphenylphosphane)molybdenum(II)
... are C—H O hydrogen-bonding inter- actions between O3 of the acetyl carbonyl on one Mo complex and H11C from a phosphine methyl substituent ...
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1 (4 Pyridinio) 2′ [4 pyridinio (E) methylidene]hydrazide dinitrate
... and C—H···O hydrogen-bonding interactions in bipyridinium nitrates (Felloni et ...the hydrogen-bonding potential of this cation compared with that of simple bipyridinium ...
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Crystal structure of 1 ethyl 3 (2 oxo 1,3 dithiol 4 yl)quinoxalin 2(1H) one
... intramolecular C—H O hydrogen- bonding interaction between the two ring systems [C O = ...bifurcated C—H O hydrogen-bonding interactions ...
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catena Poly[[[bis(1,10 phenanthroline)cadmium(II)] μ naphthalene 2,6 dicarboxylato] monohydrate]
... carboxylate O atoms and C—H groups of phen ligands of adjacent ...form O—H O and C—H O hydrogen-bonding interactions involving the carboxylate ...
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Octaaquatetrakis(μ2 2,6 diformyl 4 methylphenolato)tetra μ3 hydroxo tetraneodymium(III) trifluoromethanesulfonate butanol disolvate tetrahydrate
... the H atoms contributes to O—H O hydrogen bonding but the other is involved in an O—H interaction involving the delocalized electrons of the benzene ring and the ...
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N—H⋯O=C hydrogen bonding and O⋯O=C repulsive interactions in tert butoxycarbonyl L leucyl L alanine ethyl ester (Boc L Leu L Ala OEt)
... Even at low temperature (173 K), with Cu K radiation and an area detector, diffraction from the crystal was very weak and insuf- ®cient data were available for full anisotropic re®nement. For non-H atoms, ...
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Ethyl(S) (−) 4 chloro 3 hydroxybutyrateStudy by D F T
... DFT hydrogen bonded dimer model satisfactorily explaining the ...the O-H and C=O are participating into forming a hydrogen bond of the type O-H•••O=C ...
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Intermolecular N–H⋯O hydrogen bonding interactions in 5 fluorocytosinium salicylate
... O2 hydrogen bonds to form a linear hydrogen-bonded supramolecular chain ...O2 hydrogen bond was previously proposed for a single stranded poly(C) nucleotide based on an NMR study (Broido & ...
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3 Hydroxy 1 (4 methoxybenzyl)piperidin 2 one
... Several hydrogen bonds exist in the structure (Table 1), with the most significant being an O—H···O hydrogen ...of hydrogen bonded pairs of molecules which are related to each ...
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Highly fluorinated naphthalenes and bifurcated C–H⋯F–C hydrogen bonding
... weak hydrogen bonding acceptor groups, Dunitz and Taylor examined the C – F group 6 in a survey of crystal structures from the Cambridge Structural Database 7 and Protein Data ...on O – ...
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N—H⋯O hydrogen bonding in the adduct of N (2 aminoethyl) 2 hydroxybenzamide with picric acid
... Methyl salicylate (1.5 g, 10 mmol) was dissolved in neat ethylenedi- amine (3.0 g, 50 mmol) and re¯uxed for 4 h. The solution was concentrated under vacuum, yielding a light brown oil. The oil was dissolved in 20 ...
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Crystal structure of (4,4′ bipyridyl κN)bis[N (2 hydroxyethyl) N isopropyldithiocarbamato κ2S,S′]zinc(II)–4,4′ bipyridyl (2/1) and its isostructural cadmium(II) analogue
... hydroxy-O—H O(hydroxy) and hydroxy-O– H N(pyridyl) hydrogen bonding with all but the acidic H atoms removed and (b) a view of the unit-cell contents in projection ...
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Crystal structure of trans diammine(1,4,8,11 tetraazacyclotetradecane κ4N)chromium(III) tetrachloridozincate chloride monohydrate from synchrotron data
... and O—H Cl hydrogen-bonding ...Cl, C—H Cl, N—H O and O—H Cl hydrogen bonding between N—H or C—H groups of cyclam, ...
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Structural characterization of two solvates of a luminescent copper(II) bis(pyridine) substituted benzimidazole complex
... of hydrogen-bonding interactions present in 1, as seen in Table ...in C—H N hydrogen bonds in which an aromatic hydrogen atom (H9) is ...Additionally, C— H O ...
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1,6,6 Trimethyl 1,2,6,7,8,9 hexahydrophenanthro[1,2 b]furan 10,11 dione
... Intramolecular C—H···O hydrogen bonds are observed in the molecular structure (Table 2), but no intermolecular hydrogen bonding is observed in the crystal ...
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Multicentered hydrogen bonding in 1 [(1 deoxy β D fructopyranos 1 yl)azaniumyl]cyclopentanecarboxylate (`D fructose cycloleucine')
... The Hirshfeld surface analysis (Spackman & Jayatilaka, 2009) revealed that a major proportion of the intermolecular contacts in crystal structure of (I) is provided by non- or low- polar H H ...
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Crystal structure of bromido fac tricarbonyl[5 (3,4,5 trimethoxyphenyl) 3 (pyridin 2 yl) 1H 1,2,4 triazole κ2N2,N3]rhenium(I) methanol monosolvate
... conventional hydrogen bonding with common NH and OH donor groups and weaker hydrogen bonds formed by CH groups (Table ...short hydrogen bonds (O7—H Br1 and N2— H O7), both ...
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Tris{4 [(2H tetrazol 5 yl)methyl]morpholinium} dodecatungstophosphate hexahydrate
... precipitate was formed after five hours. The solid was filtered off, washed with DMF and dried at room temperature. The precipitate was then re-dissolved in acetonitrile and the solution was cooled to ambient ...
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