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4-(1-Adamantylmeth-yl)-N-(2-chloro-9-isopropyl-9H-purin-6-yl)aniline.

Rouchal M, Nečas M, Vícha R - Acta Crystallogr Sect E Struct Rep Online (2009)

Bottom Line: The dihedral angles between the purine and benzene rings are 39.54 (5) and 23.69 (5)° in the two mol-ecules.The adamantane cages consist of three fused cyclo-hexane rings in classical chair conformations, with C-C-C angles in the range 108 (2)-111 (2)°.In the crystal, mol-ecules are linked into dimers via two N-H⋯N hydrogen bonds.

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ABSTRACT
The asymmetric unit of the title compound, C(25)H(30)ClN(5), consists of two mol-ecules with slightly different geometrical parameters. The dihedral angles between the purine and benzene rings are 39.54 (5) and 23.69 (5)° in the two mol-ecules. The adamantane cages consist of three fused cyclo-hexane rings in classical chair conformations, with C-C-C angles in the range 108 (2)-111 (2)°. In the crystal, mol-ecules are linked into dimers via two N-H⋯N hydrogen bonds.

No MeSH data available.


ORTEP plot of the asymmetric unit with atoms represented as 50% probability ellipsoids (H-bonds are denoted as dashed lines).
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Fap1: ORTEP plot of the asymmetric unit with atoms represented as 50% probability ellipsoids (H-bonds are denoted as dashed lines).


4-(1-Adamantylmeth-yl)-N-(2-chloro-9-isopropyl-9H-purin-6-yl)aniline.

Rouchal M, Nečas M, Vícha R - Acta Crystallogr Sect E Struct Rep Online (2009)

ORTEP plot of the asymmetric unit with atoms represented as 50% probability ellipsoids (H-bonds are denoted as dashed lines).
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2969425&req=5

Fap1: ORTEP plot of the asymmetric unit with atoms represented as 50% probability ellipsoids (H-bonds are denoted as dashed lines).
Bottom Line: The dihedral angles between the purine and benzene rings are 39.54 (5) and 23.69 (5)° in the two mol-ecules.The adamantane cages consist of three fused cyclo-hexane rings in classical chair conformations, with C-C-C angles in the range 108 (2)-111 (2)°.In the crystal, mol-ecules are linked into dimers via two N-H⋯N hydrogen bonds.

View Article: PubMed Central - HTML - PubMed

ABSTRACT
The asymmetric unit of the title compound, C(25)H(30)ClN(5), consists of two mol-ecules with slightly different geometrical parameters. The dihedral angles between the purine and benzene rings are 39.54 (5) and 23.69 (5)° in the two mol-ecules. The adamantane cages consist of three fused cyclo-hexane rings in classical chair conformations, with C-C-C angles in the range 108 (2)-111 (2)°. In the crystal, mol-ecules are linked into dimers via two N-H⋯N hydrogen bonds.

No MeSH data available.