Concepedia

Thermodynamic, energetic, and topological properties of crystal packing of pyrazolo[1,5-a]pyrimidines governed by weak electrostatic intermolecular interactions

Clarissa P. Frizzo, Aniele Z. Tier, Izabelle M. Gindri, Alexandre R. Meyer, Gabrielle Black, Andrei L. Belladona, Marcos A. P. Martins

CrystEngComm · 2015 · 20 citations · 52 references

DOI

Concepts

Abstract

The relationship between energetic and topological properties of crystals with weak electrostatic intermolecular interactions and thermodynamic data are presented.

References

52

A short history of<i>SHELX</i>

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 87.4K citations · Full text

, , +16

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

Samuel Francis Boys, Fernando Bernardi · Molecular Physics · 1970 · 22K citations

, , +10

Crystal Engineering: A Holistic View

Gautam R. Desiraju · Angewandte Chemie International Edition · 2007 · 1.5K citations

, , +17

Molecular crystals and molecules

Materials Research Bulletin · 1974 · 1.1K citations

, , +12

Calculation of absorption corrections for camera and diffractometer data

P. Coppens, Leslie Leiserowitz, D. Rabinovich · Acta Crystallographica · 1965 · 668 citations · Full text

, , +4