Nonclassical active site for enhanced gas sorption in porous coordination polymer.
Gas sorption experiments and grand canonical Monte Carlo simulations for two isostructural microporous metal azolate frameworks show that even partially exposed uncoordinated nitrogens can effectively increase gas binding affinity and overcome the pore size confinement effect.
Lin
Jian-Bin
JB
MOE Key Laboratory of Bioinorganic and Synthetic Chemistry, State Key Laboratory of Optoelectronic Materials and Technologies, School of Chemistry and Chemical Engineering, Sun Yat-Sen University, Guangzhou 510275, China.
Zhang
Jie-Peng
JP
Chen
Xiao-Ming
XM
D000327:Adsorption; D005740:Gases / Q000737:chemistry*; D008958:Models, Molecular; D008968:Molecular Conformation; D009010:Monte Carlo Method; D009942:Organometallic Compounds / Q000737:chemistry; D011108:Polymers / Q000737:chemistry*; D016062:Porosity; D014230:Triazoles / Q000737:chemistry
D005740:Gases; D009942:Organometallic Compounds; D011108:Polymers; D014230:Triazoles