Alkane Global Minima

Introduction

Energies calculated using the MM2* force field, as implemented on MacroModel version 5.5.
All energies are in kJ/mol

Formula	Energy	Formula	Energy
C₂₁H₄₄	49.05	C₂₆H₅₄	51.90
C₂₂H₄₆	49.00	C₂₇H₅₆	53.27
C₂₃H₄₈	50.42	C₂₈H₅₈	53.59
C₂₄H₅₀	50.77	C₂₉H₆₀	54.71
C₂₅H₅₂	51.90	C₃₀H₆₂	54.73

Formula	Energy	Formula	Energy
C₁₁H₂₄	28.11	C₁₆H₃₄	41.70
C₁₂H₂₆	30.83	C₁₇H₃₆	44.41
C₁₃H₂₈	33.54	C₁₈H₃₈	46.09
C₁₄H₃₀	36.26	C₁₉H₄₀	47.55
C₁₅H₃₂	38.98	C₂₀H₄₂	47.87