Part of JINC-01 — Coordination Compounds: Nomenclature, Isomerism & CFT

Crystal Field Theory — Fundamentals

by Notetube Officialtheory_summary summary212 words9 views

wordcountword_{count}: 280

Crystal Field Theory (CFT) explains bonding in coordination compounds using a purely electrostatic model. Ligands are treated as point charges (or point dipoles) that create an electric field around the central metal ion.

In a free metal ion, all five d-orbitals are degenerate (equal energy). When ligands approach, this degeneracy is broken. The pattern of splitting depends on geometry:

Octahedral: Ligands along x, y, z axes push dx2-y2 and dz2 (eg set) to higher energy (they point directly at ligands). dxy, dyz, dxz (t2g set) go lower. Splitting = DeltaoctDelta_{oct}. Barycentre maintained: t2g stabilised by 0.4 DeltaoctDelta_{oct}, eg destabilised by 0.6 DeltaoctDelta_{oct}.

Tetrahedral: Splitting is inverted. e set (dx2-y2, dz2) goes lower, t2 set (dxy, dyz, dxz) goes higher. DeltatetDelta_{tet} = 49\frac{4}{9} DeltaoctDelta_{oct}. Small splitting means virtually always high spin.

Square planar: Energy order — dxz, dyz < dz2 < dxy < dx2-y2 (highest). Large splitting of dx2-y2 favours this geometry for d8 with strong field ligands.

CFSE (Crystal Field Stabilisation Energy) = sum of (-0.4 x nt2gn_{t2g} + 0.6 x negn_{eg}) x DeltaoctDelta_{oct}. Maximum CFSE: d3 in high spin (-1.2 DeltaoctDelta_{oct}) and d6 in low spin (-2.4 DeltaoctDelta_{oct}). Zero CFSE: d0, d5 high spin, d10. CFSE determines thermodynamic stability, kinetic lability, colour preferences, and site preferences in crystal structures.

Want to generate AI summaries of your own documents? NoteTube turns PDFs, videos, and articles into study-ready summaries.

Sign up free to create your own