Phase AssignmentSupport assessment: High
The framework reversibly transforms among anhydrate 1, dihydrate 1·2H2O and trihydrate 1·3H2O depending on water content.
Caveat: Hydrogen atom positions are limited by SCXRD; CIF files were not available locally.
7704 · Structural Analysis · Figures 1, 4, 5; Table 1 · Linked to 4 structured results
Structure Property LinkSupport assessment: High
Anhydrate 1 shows negligible N2 uptake despite strong water adsorption, consistent with a narrow interlayer accessible to smaller water molecules and hydrogen bonding.
Caveat: The small numerical N2 uptake was visually estimated from SI Figure S1.
7703 · Structural Analysis · Figure S1 · Linked to 2 structured results
Structure Property LinkSupport assessment: High
Guest water adsorption/desorption reforms hydrogen-bonding networks and controls proton conductivity over about ten orders of magnitude.
Caveat: Intermediate humidity conductivities are primarily graphical except for the key phase values reported in text.
7705 · Proton Conduction · Figure 7 · Linked to 6 structured results
Transport MechanismSupport assessment: Medium
The authors hypothesise a Grotthuss-type mechanism in 1·3H2O because a vehicle mechanism is unlikely in the confined interlayer space.
Caveat: The paper explicitly states that SCXRD and conductivity measurements have limited ability to resolve hydrogen motion, and further neutron scattering was ongoing.
7705 · Proton Conduction · Figure 5 · Linked to 3 structured results
Transport MechanismSupport assessment: Medium
The microwave response is attributed to rotational or vibrational molecular motions embedded in the framework rather than direct proton conduction.
Caveat: The microscopic motion is inferred; hydrogen-atom dynamics were not directly observed.
7706 · Proton Conduction · Figure 8 · Linked to 3 structured results