{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["68(Pt 6)"],"submitter":["Shin JW"],"pubmed_abstract":["In the title compound, C(21)H(18)N(6)·H(2)O, two 4,4'-dipyridyl-amine groups are linked by a methyl-ene C atom, which sits on a twofold axis. The lattice water mol-ecule is located slightly off a twofold axis, and is therefore disordered over two positions. In the crystal, the organic mol-ecules and the water mol-ecule are linked by O-H⋯N hydrogen bonds. The organic mol-ecules exhibit extensive offset face-to-face π-π inter-actions to symmetry equivalents [centroid-centroid distances = 3.725 (3) and 4.059 (3) Å]."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1600"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC3379210"],"repository":["biostudies-literature"],"pubmed_title":["N,N,N',N'-Tetra-kis(pyridin-4-yl)methane-diamine monohydrate."],"pmcid":["PMC3379210"],"pubmed_authors":["Shin JW","Min KS"],"additional_accession":[]},"is_claimable":false,"name":"N,N,N',N'-Tetra-kis(pyridin-4-yl)methane-diamine monohydrate.","description":"In the title compound, C(21)H(18)N(6)·H(2)O, two 4,4'-dipyridyl-amine groups are linked by a methyl-ene C atom, which sits on a twofold axis. The lattice water mol-ecule is located slightly off a twofold axis, and is therefore disordered over two positions. In the crystal, the organic mol-ecules and the water mol-ecule are linked by O-H⋯N hydrogen bonds. The organic mol-ecules exhibit extensive offset face-to-face π-π inter-actions to symmetry equivalents [centroid-centroid distances = 3.725 (3) and 4.059 (3) Å].","dates":{"release":"2012-01-01T00:00:00Z","publication":"2012 Jun","modification":"2025-04-05T12:59:50.945Z","creation":"2019-03-27T00:54:42Z"},"accession":"S-EPMC3379210","cross_references":{"pubmed":["22719408"],"doi":["10.1107/S1600536812019010"]}}