Molecular polarityRunning
Bonding bench. Charge separation at 0.256 Å. Dipole moment 0.307 D, Filter threshold 1.85 D. Currently dipole moment is short by 1.54 D.TUNINGδ+δ−0.256 Å
t = 0.0s

Dipole moment

0.307D

Filter threshold

1.85D

Dipole moment is short by 1.54 D

0.256 Å

Bonding bench. Charge separation at 0.256 Å. Dipole moment 0.307 D, Filter threshold 1.85 D. Currently dipole moment is short by 1.54 D.

What has to balanceμ=qr\mu = qr

What is happening

You take control of a membrane filter that lets the wrong molecules through.

The prediction is useless as it stands. The filter blocks anything with a dipole moment above 1.85 D, and the modelled charge separation is wrong.