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6-(2-Methoxy-benzyl-amino)purine.

Trávníček Z, Matiková-Maľarová M, Mikulík J - Acta Crystallogr Sect E Struct Rep Online (2008)

Bottom Line: The benzene and purine ring systems make a dihedral angle of 77.58 (3)°.The crystal structure is further stabilized by intra-molecular N⋯O inter-actions [2.9541 (12) Å] and inter-molecular C-H⋯C and C⋯C contacts [3.304 (2), 3.368 (2), 3.667 (2), 3.618 (2) and 3.512 (2) Å] which arrange the mol-ecules into graphite-like layers.The inter-layer separations are 3.248 and 3.256 Å.

View Article: PubMed Central - HTML - PubMed

Affiliation: Department of Inorganic Chemistry, Faculty of Science, Palacký University, Křížkovského 10, CZ-771 47 Olomouc, Czech Republic.

ABSTRACT
The title compound, C(13)H(13)N(5)O, consists of discrete mol-ecules connected by N-H⋯N hydrogen bonds to form infinite chains, with N⋯N separations of 3.0379 (15) and 2.8853 (15) Å. The benzene and purine ring systems make a dihedral angle of 77.58 (3)°. The crystal structure is further stabilized by intra-molecular N⋯O inter-actions [2.9541 (12) Å] and inter-molecular C-H⋯C and C⋯C contacts [3.304 (2), 3.368 (2), 3.667 (2), 3.618 (2) and 3.512 (2) Å] which arrange the mol-ecules into graphite-like layers. The inter-layer separations are 3.248 and 3.256 Å.

No MeSH data available.


Related in: MedlinePlus

Part of the crystal structure of (I), showing the formation of graphite-like layers. Dashed lines represent the shortest distances between two neighbouring layers formed by purine moieties (d1 = 3.256, d2 = 3.248 Å). H-atoms have been omitted for clarity.
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Fap4: Part of the crystal structure of (I), showing the formation of graphite-like layers. Dashed lines represent the shortest distances between two neighbouring layers formed by purine moieties (d1 = 3.256, d2 = 3.248 Å). H-atoms have been omitted for clarity.


6-(2-Methoxy-benzyl-amino)purine.

Trávníček Z, Matiková-Maľarová M, Mikulík J - Acta Crystallogr Sect E Struct Rep Online (2008)

Part of the crystal structure of (I), showing the formation of graphite-like layers. Dashed lines represent the shortest distances between two neighbouring layers formed by purine moieties (d1 = 3.256, d2 = 3.248 Å). H-atoms have been omitted for clarity.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2961176&req=5

Fap4: Part of the crystal structure of (I), showing the formation of graphite-like layers. Dashed lines represent the shortest distances between two neighbouring layers formed by purine moieties (d1 = 3.256, d2 = 3.248 Å). H-atoms have been omitted for clarity.
Bottom Line: The benzene and purine ring systems make a dihedral angle of 77.58 (3)°.The crystal structure is further stabilized by intra-molecular N⋯O inter-actions [2.9541 (12) Å] and inter-molecular C-H⋯C and C⋯C contacts [3.304 (2), 3.368 (2), 3.667 (2), 3.618 (2) and 3.512 (2) Å] which arrange the mol-ecules into graphite-like layers.The inter-layer separations are 3.248 and 3.256 Å.

View Article: PubMed Central - HTML - PubMed

Affiliation: Department of Inorganic Chemistry, Faculty of Science, Palacký University, Křížkovského 10, CZ-771 47 Olomouc, Czech Republic.

ABSTRACT
The title compound, C(13)H(13)N(5)O, consists of discrete mol-ecules connected by N-H⋯N hydrogen bonds to form infinite chains, with N⋯N separations of 3.0379 (15) and 2.8853 (15) Å. The benzene and purine ring systems make a dihedral angle of 77.58 (3)°. The crystal structure is further stabilized by intra-molecular N⋯O inter-actions [2.9541 (12) Å] and inter-molecular C-H⋯C and C⋯C contacts [3.304 (2), 3.368 (2), 3.667 (2), 3.618 (2) and 3.512 (2) Å] which arrange the mol-ecules into graphite-like layers. The inter-layer separations are 3.248 and 3.256 Å.

No MeSH data available.


Related in: MedlinePlus