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  2. Bond order - Wikipedia

    en.wikipedia.org/wiki/Bond_order

    The bond order itself is the number of electron pairs (covalent bonds) between two atoms. [3] For example, in diatomic nitrogen N≡N, the bond order between the two nitrogen atoms is 3 (triple bond). In acetylene H–C≡C–H, the bond order between the two carbon atoms is also 3, and the C–H bond order is 1 (single bond).

  3. Borate - Wikipedia

    en.wikipedia.org/wiki/Borate

    Borate anions (and functional groups) consist of trigonal planar BO 3 and/or tetrahedral BO 4 structural units, joined together via shared oxygen atoms (corners) or atom pairs (edges) into larger clusters so as to construct various ions such as [B 2 O 5] 4, [B 3 O 8] 7, [B 4 O 12] 12, [B 5 O 6 (OH) 5] 2, [B 6 O 13] 8, etc. These ...

  4. Benson group increment theory - Wikipedia

    en.wikipedia.org/wiki/Benson_group_increment_theory

    The C(C B)(C)(H)2 accounts for the carbon linked to the benzene group on the butyl moiety. The 2' carbon of the butyl group would be C(C) 3 (H) because it is a tertiary carbon (connecting to three other carbon atoms). The final calculation comes from the CH 3 groups connected to the 2' carbon; C(C)(H) 3.

  5. Tetrahedral molecular geometry - Wikipedia

    en.wikipedia.org/wiki/Tetrahedral_molecular_geometry

    In a tetrahedral molecular geometry, a central atom is located at the center with four substituents that are located at the corners of a tetrahedron.The bond angles are arccos( ⁠ 1 / 3 ⁠) = 109.4712206...° ≈ 109.5° when all four substituents are the same, as in methane (CH 4) [1] [2] as well as its heavier analogues.

  6. Group-contribution method - Wikipedia

    en.wikipedia.org/wiki/Group-contribution_method

    The simplest form of a group-contribution method is the determination of a component property by summing up the group contributions : [] = +.This simple form assumes that the property (normal boiling point in the example) is strictly linearly dependent on the number of groups, and additionally no interaction between groups and molecules are assumed.

  7. 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 ...

  8. Hückel method - Wikipedia

    en.wikipedia.org/wiki/Hückel_method

    To summarize, we are assuming that: (1) the energy of an electron in an isolated C(2p z) orbital is =; (2) the energy of interaction between C(2p z) orbitals on adjacent carbons i and j (i.e., i and j are connected by a σ-bond) is =; (3) orbitals on carbons not joined in this way are assumed not to interact, so = for nonadjacent i and j; and ...

  9. Three-center two-electron bond - Wikipedia

    en.wikipedia.org/wiki/Three-center_two-electron_bond

    A BHB 3-center-2-electron bond is formed when a boron atom shares electrons with a BH bond on another boron atom. The two electrons (corresponding to one bond) in a BHB bonding molecular orbital are spread out across three internuclear spaces. [1] In diborane (B 2 H 6), there are two such 3c-2e bonds: two H atoms bridge the two B ...