Structural Archive
Explore a curated three-dimensional collection of cucurbituril-related single-crystal structures from our group and the wider research community.
We gratefully acknowledge the support of the Shanghai Synchrotron Radiation Facility.
The 1:2 complex pairs two extended 4-terphenylpyridinium guests within CB[8], illustrating the aromatic overlap used to suppress axial slippage (CCDC 2474359).
View publicationA centrosymmetric BPP molecule forms a parallel slipped dyad with a 3.438 Å interchromophore spacing, the free-state reference for confinement-induced structural restriction (CCDC 2444592).
View publicationOne protonated Anderson-type NH₂POM is linked at both termini to two CB[5] portals by five-point contacts, defining the anisotropic growth axis (CCDC 2452567).
View publicationA CB[5] outer wall contacts four neighboring CH₃POM clusters without portal engagement, producing a more isotropic packing motif (CCDC 2452568).
View publicationThe 1:2 complex pairs two 4-biphenylpyridinium guests within CB[8], confirming the binding geometry inferred from NMR (CCDC 2474071).
View publicationAxially chiral BINAD compresses to a 77° dihedral angle and induces an 18° helical twist in the stacked phenylpyridinium units (CCDC 2404494).
View publicationTwo parallel BPP guests are clamped by two CB[8] hosts, while a symmetry-related Na⁺ pair bridges both CB[8] portals and the BPP carbonyls (CCDC 2417619).
View publicationRing-in-rings complex featuring a cofacial para-benzene dyad and oppositely oriented carbonyl pairs (CCDC 2402048).
View publicationSolid-state evidence for antiparallel cofacial stacking of a 1,4-naphthalene dyad (CCDC 2402049).
View publicationRing-in-rings complex with a cofacial 2,7-naphthalene dyad and aligned carbonyl pairs (CCDC 2402032).
View publicationExtended ring-in-rings complex displaying a cofacial para-biphenyl dyad within dual CB[8] clamps (CCDC 2402050).
View publicationDual-CB[8]-restricted ring-in-rings complex with a cofacial meta-benzene dyad (CCDC 2402046).
View publicationCB[8] binds the nonterminal Leu/Tyr dipeptide site of Gly-Gly-Leu-Tyr-Gly-Gly-Gly, revealing a pair-inclusion motif and host-induced type II β-turn (CCDC 2312293).
View publicationTwo CB[8] hosts organize two hydroxytriazine-linked bis(bromophenylpyridinium) guests into the quaternary stacking motif used for visible-light-excited aqueous RTP (CCDC 1951720).
View publicationThe G3 control crystallizes as a 2:1 CB[8] complex without the unusual cationic Py⁺/Py⁺ stacking seen for G2 (CCDC 1813463).
View publicationThe G4 control pairs two methoxycarbonyl-pyridylamide phenylpyridinium guests in a 2:1 CB[8] complex (CCDC 1813464).
View publicationThe G5 control forms a 2:1 CB[8] complex with carboxypyridylamide phenylpyridinium guests, contrasting the multivalent G1/G2 dimerization motifs (CCDC 1813465).
View publicationG1 forms a 2:2 quaternary CB[8] complex in which the hosts capture antiparallel Py⁺/benzyl heterodimers at the two ends of the backbone (CCDC 1810722).
View publicationG2 forms a 2:2 quaternary complex that places two cationic Py⁺ units in parallel stacking inside each CB[8] cavity (CCDC 1810723).
View publicationCB[8] pairs two p-methoxyphenyl-N-methylpyridinium T1 guests in a head-to-tail 1:2 complex from the Chem. Asian J. study (CCDC 977538).
View publicationCB[8] captures two p-(methylthio)phenyl-N-methylpyridinium T2 guests as a head-to-tail 1:2 aromatic dyad (CCDC 977539).
View publicationCB[8] binds Trp-Gly-Gly through indole inclusion and N-terminal ammonium chelation at the portal, capturing the sequence-specific recognition motif from the JACS 2006 study.
View publicationTwo Phe-Gly-Gly guests share one CB[8] cavity, visualizing the cooperative dimerization mode driven by paired phenyl inclusion and portal ammonium contacts.
View publicationNo structures match these filters.