MakarovSuites
English
EnglishDeutschРусскийУкраїнськаFrançaisEspañolItalianoPolski
Contact & licences

Physics

Molecular shapes

Molecules in three dimensions with their shapes worked out, not looked up: the library holds only what is bonded to what, and the tetrahedron, the ring, the octahedron and the buckyball fall out of a relaxation you can watch.

Molecular shapes — Actual application image
Actual application image

What happens

Nothing here is looked up: the library says only what is bonded to what, and the structure is relaxed on screen until the tetrahedron's 109.47°, water's 104°, benzene's flat hexagon at 1.398 Å and the closed buckyball fall out on their own. Lone pairs are drawn as pale lobes with no atom on the end, because they are the reason water is bent. The panel prints what the model found next to what the laboratory measured, so you can watch it be right - and, in cubane's case, fail its own rules and print what that costs. The showcase holds 84 molecules on a shelf along the bottom - click one to lift it onto the table - with cards, chips and a search in the panel; beside each stands the dipole moment computed from its geometry next to the measured one, and the gold arrow draws it.

Equations used in the module
Equations
VSEPR: domains repel on a sphere,  E = Σ 1 / r_ij
lone pairs repel more than bonds
2 → linear 180°, 3 → 120°, 4 → 109.5°, 6 → 90°

Related experiments

Back to catalogue
Black hole — Actual application image

Physics / Astronomy

Black hole

Gravitational lensing: ray tracing of Schwarzschild geodesics.

Distance-field fractals — Actual application image

Physics / Math

Distance-field fractals

Surfaces with no mesh: a distance estimator and sphere tracing draw the whole thing.