TY  - JOUR
A1  - Rivera, Augusto
A1  - Ríos-Motta, Jaime
A1  - Bolte, Michael
T1  - First hydrogen-bonded adduct of sterically hindered 2-tert-butyl-4-methyl­phenol (TBMP) with 1,3,6,8-tetra­aza­tri­cyclo­[4.4.1.13,8]dodecane (TATD) via coupling of classical hydrogen bonds and C—H...π non-covalent inter­actions
T2  - Acta Crystallographica. Section E, Crystallographic communications
N2  - The title compound, C8H16N4·2C11H16O, was synthesized from the corres­ponding sterically crowded phenol by treatment with the aminal cage polyamine. Single-crystal X-ray diffraction structural analysis revealed the three-mol­ecule aggregate to crystallize in the monoclinic space group P2/c with one half of a 1,3,6,8-tetra­aztri­cyclo­[4.4.1.13,8]dodecane (TATD) mol­ecule and one 2-tert-butyl-4-methyl­phenol mol­ecule per asymmetric unit. The crystal structure features inter­molecular O—H...N and C—H...O hydrogen bonds, as well as inter­molecular C—H...π inter­actions.
KW  - crystal structure
KW  - co-crystalline adduct
KW  - hydrogen bonding
KW  - C-H...[pi] interactions
KW  - TBMP
KW  - TATD
Y1  - 2022
UR  - http://publikationen.ub.uni-frankfurt.de/frontdoor/index/index/docId/75777
UR  - https://nbn-resolving.org/urn:nbn:de:hebis:30:3-757770
SN  - 2056-9890
VL  - 78
IS  - 6
SP  - 599
EP  - 602
PB  - International Union of Crystallography
CY  - Chester
ER  -