Search results for "Maximum displacement"

showing 2 items of 2 documents

Dibromido[N-(1-diethylamino-1-oxo-3-phenylpropan-2-yl)-N′-(pyridin-2-yl)imidazol-2-ylidene]palladium(II) dichloromethane monosolvate

2019

In the molecule of the title N,N′-disubstituted imidazol-2-ylidene palladium(II) complex, [PdBr2(C21H24N4O)]·CH2Cl2, the palladium(II) atom adopts a slightly distorted square-planar coordination (r.m.s. deviation = 0.0145 Å), and the five-membered chelate ring is almost planar [maximum displacement = 0.015 (8) Å]. The molecular conformation is enforced by intramolecular C—H...Br hydrogen bonds. In the crystal, complex molecules and dichloromethane molecules are linked into a three-dimensional network by C—H...O and C—H...Br hydrogen bonds.

crystal structureHydrogen bondchemistry.chemical_element02 engineering and technologyGeneral MedicineCrystal structure010402 general chemistry021001 nanoscience & nanotechnologyRing (chemistry)palladium01 natural sciencesMedicinal chemistryMethane0104 chemical scienceschemistry.chemical_compoundchemistrylcsh:QD901-999Chelationlcsh:Crystallography0210 nano-technologyMaximum displacementimidazol-2-ylidenePalladiumIUCrData
researchProduct

Crystal structure of (E)-pent-2-enoic acid

2015

The molecule of the title compound, C5H8O2, a low-melting α,β-unsaturated carboxylic acid, is essentially planar [maximum displacement = 0.0239 (13) Å]. In the crystal, molecules are linked into centrosymmetric dimersviapairs of O—H...O hydrogen bonds.

crystal structurehydrogen bondunsaturated carb­oxy­lic acidHydrogen bondDimerGeneral ChemistryCrystal structureCondensed Matter Physicscomputer.software_genredimerData ReportsCrystallcsh:ChemistryCrystallographychemistry.chemical_compoundPlanarchemistrylcsh:QD1-999General Materials ScienceData miningMaximum displacementcomputerunsaturated carboxylic acidActa Crystallographica Section E: Crystallographic Communications
researchProduct