B. C. Manjunath
University of Mysore
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Acta Crystallographica Section E-structure Reports Online | 2013
M. Manjula; P. Jayaroopa; B. C. Manjunath; K. Ajay Kumar; N. K. Lokanath
In the title compound, C16H16N2, the dihydropyrazole ring adopts a shallow envelope conformation, with the C atom bearing the phenyl group displaced by 0.298 (2) Å from the other atoms (r.m.s. deviation = 0.015 Å). The dihedral angles between the four near coplanar atoms of the central ring and the N- and C-bonded phenyl groups are 13.49 (13) and 82.22 (16)°, respectively.
Acta Crystallographica Section E-structure Reports Online | 2014
B. C. Manjunath; M. Manjula; K. R. Raghavendra; K. Ajay Kumar; N. K. Lokanath
In the title compound, C20H14F3NS2, the seven-membered thiazepine ring adopts a slightly distorted twist–boat conformation. The mean plane of the five-membered thiophene ring fused to the thiazepine ring is twisted by 32.3 (3) and 55.6 (4)° from the benzene and phenyl rings, respectively. In the crystal, inversion dimers linked by pairs of weak C—H⋯N interactions are observed.
Acta Crystallographica Section E-structure Reports Online | 2013
M. M. M. Abdoh; S. Madan Kumar; K.S. Vinay Kumar; B. C. Manjunath; M. P. Sadashiva; N. K. Lokanath
In the title orthorhombic polymorph (space group Iba2), C17H13N, the dihedral angle between the benzene rings is 55.99 (10)° and the azepine ring adopts a boat conformation. In the crystal, molecules are linked by C—H⋯π contacts. The previously-reported polymorph [Yousuf et al. (2012 ▶). Acta Cryst. E68, o1101] crystallizes in the monoclinic system (space group P21/c) with two molecules in the asymmetric unit.
Acta Crystallographica Section E-structure Reports Online | 2013
M. Manjula; B. C. Manjunath; N. Renuka; K. Ajay Kumar; N. K. Lokanath
In the title compound, C19H14FNS2, the seven-membered thiazepine ring adopts a slightly distorted twist boat conformation. The dihedral angle between the benzene rings is 53.6 (1)°. The mean plane of the thiazepine ring is twisted by 34.3 (7)° and 36.6 (7)° from the benezene rings. A C—H⋯F interaction generates stacking of molecules along the ab plane.
Acta Crystallographica Section E-structure Reports Online | 2013
B. C. Manjunath; K.S. Vinay Kumar; S. Madan Kumar; M. P. Sadashiva; N. K. Lokanath
In the title compound, C24H20N4, the azepine ring adopts a boat conformation and the dihedral angle between the benzene rings fused to it is 57.95 (8)°. The bond-angle sum at the azepine N atom is 346.6°, indicating a significant deviation from planarity. The triazole ring subtends a dihedral angle of 71.45 (10)° with the terminal phenyl group. A weak intramolecular C—H⋯Na (a = azepine) interaction occurs, which closes an S(6) ring.
Acta Crystallographica Section E-structure Reports Online | 2013
B. C. Manjunath; Koravangala S. Vinay Kumar; S.M. Kumar; M. P. Sadashiva; N. K. Lokanath
In the title compound, C24H20N4, the azepine ring adopts a boat conformation. The dihedral angle between the benzene rings fused to the azepine ring is 49.40 (9)°. The triazole ring makes a dihedral angle of 77.88 (9)° with the terminal phenyl ring. In the crystal, molecules are linked via C—H⋯π interactions and a parallel slipped π–π interaction [centroid–centroid distance = 3.7324 (9), normal distance = 3.4060 (6) and slippage = 1.526 Å], forming a three-dimensional network.
Acta Crystallographica Section E-structure Reports Online | 2014
B. C. Manjunath; M. Manjula; K. R. Raghavendra; S. Shashikanth; K. Ajay Kumar; N. K. Lokanath
In the title compound, C21H19NO2S2, the seven-membered thiazepine ring adopts a slightly distorted twist boat conformation. The dihedral angle between the benzene rings is 67.4 (2)°. The mean plane of the thiophene ring is twisted by 59.3 (2) and 87.7 (2)° from the mean planes of the benezene rings. In the crystal, inversion dimers linked by pairs of C—H⋯O hydrogen bonds generate R 2 2(20) loops.
Acta Crystallographica Section E-structure Reports Online | 2012
M. M. M. Abdoh; V. Srinivasa Murthy; B. C. Manjunath; S. Shashikanth; N. K. Lokanath
In the title compound, C13H7Cl3O2, the dihedral angle between the benzene rings is 82.1 (2)°. The dihedral angle between the CO2 group and its carbon-bonded ring is 14.50 (19)° In the crystal, aromatic π–π stacking interactions [minimum ring centroid separation = 3.604 (2) Å] occur.
Acta Crystallographica Section E-structure Reports Online | 2013
B. C. Manjunath; S. Madan Kumar; A. C. Vinayaka; S. Jayasheelan; M. P. Sadashiva; N. K. Lokanath
The asymmetric unit of the triclinic polymorph of the title compound, C21H25N3O3, consists of two molecules, whereas for the monoclinic polymorph Z′ = 1 [Fun et al. (2009 ▶). Acta Cryst. E65, o445]. The two molecules exhibit an E configuration with respect to the C=N bond. The molecules are linked into dimers by N—H⋯O and C—H⋯O hydrogen bonds forming R 2 2(8) ring motifs. In addition, π–π interactions occur between nitrophenyl groups [minimum centroid–centroid distance 3.940 (2) Å], stacking the molecules along the ac plane.
Acta Crystallographica Section E-structure Reports Online | 2013
A. Bushra Begum; S. Madan Kumar; B. C. Manjunath; Shaukath Ara Khanum; N. K. Lokanath
In the title molecule, C13H8Cl2O2, the dihedral angle between the benzene rings is 74.53 (9)°. An intramolecular O—H⋯O hydrogen bond leading to a S(6) ring is observed. In the crystal, the molecules are connected into a three-dimensional network by C—H⋯O and π–π [inter-centroid distance = 3.6254 (10) Å] interactions.