10-Methyl-2-oxo-4-phenyl-2,11-di-hydro-pyrano[2,3-a]carbazole-3-carbo-nitrile.

Acta Crystallogr Sect E Struct Rep Online

Postgraduate Research Department of Physics, Rajah Serfoji Government College (Autonomous), Thanjavur 613 005, Tamilnadu, India.

Published: June 2013

AI Article Synopsis

  • The molecule C23H14N2O2 has atoms in its carbazole unit that slightly deviate from a flat structure, with the maximum deviation being 0.1018 Å.
  • The pyrrole ring within the molecule forms several dihedral angles with neighboring rings, ranging from very small angles like 2.18° to a larger angle of 56.44°.
  • In the crystal structure, pairs of hydrogen bonds and various π-π interactions create a complex three-dimensional network, enhancing molecular stability and arrangement.

Article Abstract

In the title mol-ecule, C23H14N2O2, the atoms in the carbazole unit deviate from planarity [maximum deviation from mean plane = 0.1018 (8) Å]. The pyrrole ring makes dihedral angles of 4.44 (5), 3.84 (5), 2.18 (5) and 56.44 (5)° with the pyran, fused benzene rings and phenyl ring, respectively. In the crystal, pairs of N-H⋯O hydrogen bonds generate R 2 (2)(14) loops and a C-H⋯N inter-action is also found. Mol-ecules are further linked by a number of π-π interactions [centroid-centroid distances vary from 3.5702 (5) to 3.7068 (6) Å], forming a three-dimensional network.

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Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3684919PMC
http://dx.doi.org/10.1107/S1600536813011823DOI Listing

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10-Methyl-2-oxo-4-phenyl-2,11-di-hydro-pyrano[2,3-a]carbazole-3-carbo-nitrile.

Acta Crystallogr Sect E Struct Rep Online

June 2013

Postgraduate Research Department of Physics, Rajah Serfoji Government College (Autonomous), Thanjavur 613 005, Tamilnadu, India.

Article Synopsis
  • The molecule C23H14N2O2 has atoms in its carbazole unit that slightly deviate from a flat structure, with the maximum deviation being 0.1018 Å.
  • The pyrrole ring within the molecule forms several dihedral angles with neighboring rings, ranging from very small angles like 2.18° to a larger angle of 56.44°.
  • In the crystal structure, pairs of hydrogen bonds and various π-π interactions create a complex three-dimensional network, enhancing molecular stability and arrangement.
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