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  2. Hydrogen bond - Wikipedia

    en.wikipedia.org/wiki/Hydrogen_bond

    Consequently, hydrogen bonds between or within solute molecules dissolved in water are almost always unfavorable relative to hydrogen bonds between water and the donors and acceptors for hydrogen bonds on those solutes. [44] Hydrogen bonds between water molecules have an average lifetime of 10 −11 seconds, or 10 picoseconds. [45]

  3. Infrared spectroscopy correlation table - Wikipedia

    en.wikipedia.org/wiki/Infrared_spectroscopy...

    An infrared spectroscopy correlation table (or table of infrared absorption frequencies) is a list of absorption peaks and frequencies, typically reported in wavenumber, for common types of molecular bonds and functional groups.

  4. Molecular orbital diagram - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital_diagram

    The σ from the 2p is more non-bonding due to mixing, and same with the 2s σ. This also causes a large jump in energy in the 2p σ* orbital. The bond order of diatomic nitrogen is three, and it is a diamagnetic molecule. [12] The bond order for dinitrogen (1σ g 2 1σ u 2 2σ g 2 2σ u 2 1π u 4 3σ g 2) is three because two electrons are now ...

  5. Molecular vibration - Wikipedia

    en.wikipedia.org/wiki/Molecular_vibration

    A molecular vibration is a periodic motion of the atoms of a molecule relative to each other, such that the center of mass of the molecule remains unchanged. The typical vibrational frequencies range from less than 10 13 Hz to approximately 10 14 Hz, corresponding to wavenumbers of approximately 300 to 3000 cm −1 and wavelengths of approximately 30 to 3 μm.

  6. Scoring functions for docking - Wikipedia

    en.wikipedia.org/wiki/Scoring_functions_for_docking

    One lost hydrogen bond can account for 1–2 orders of magnitude in binding affinity. [14]), number of hydrogen bonds (favorable contribution to affinity, especially if shielded from solvent, if solvent exposed no contribution), number of rotatable bonds immobilized in complex formation (unfavorable conformational entropy contribution).

  7. Molecular geometry - Wikipedia

    en.wikipedia.org/wiki/Molecular_geometry

    Molecular geometries can be specified in terms of 'bond lengths', 'bond angles' and 'torsional angles'. The bond length is defined to be the average distance between the nuclei of two atoms bonded together in any given molecule. A bond angle is the angle formed between three atoms across at least two bonds.

  8. Hydrogen compounds - Wikipedia

    en.wikipedia.org/wiki/Hydrogen_compounds

    By some definitions, "organic" compounds are only required to contain carbon. However, most of them also contain hydrogen, and because it is the carbon-hydrogen bond that gives this class of compounds most of its particular chemical characteristics, carbon-hydrogen bonds are required in some definitions of the word "organic" in chemistry. [12]

  9. Beta sheet - Wikipedia

    en.wikipedia.org/wiki/Beta_sheet

    For example, residue i may form hydrogen bonds to residues j − 1 and j + 1; this is known as a wide pair of hydrogen bonds. By contrast, residue j may hydrogen-bond to different residues altogether, or to none at all. The hydrogen bond arrangement in parallel beta sheet resembles that in an amide ring motif with 11 atoms.