D. Reuben Jonathan
Madras Christian College
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Acta Crystallographica Section E: Crystallographic Communications | 2015
K. Prathebha; D. Reuben Jonathan; B. K. Revathi; S. Sathya; G. Usha
In the title compound, C14H19ClN2O2·H2O, the piperdine ring adopts a chair conformation. The dihedral angle between the mean plane of the piperidine ring and that of the phenyl ring is 41.64 (1)°. In the crystal, molecules are linked by O—H⋯N, N—H⋯O and C—H⋯O hydrogen bonds involving the water molecule, forming double-stranded chains propagating along [010].
Acta Crystallographica Section E: Crystallographic Communications | 2015
J. Srividya; D. Reuben Jonathan; B. K. Revathi; G. Anbalagan
The title compound, C22H20O5, is composed of a hydroxynaphthyl ring and a trimethoxyphenyl ring [the planes of which are inclined to one another by 21.61 (10)°] bridged by an unsaturated prop-2-en-1-one group. The mean plane of the prop-2-en-1-one group [–C(=O)—C=C–] is inclined to that of the naphthyl system and benzene rings by 3.77 (14) and 18.01 (16)°, respectively. There is an intramolecular O—H⋯O hydrogen bond present forming an S(6) ring motif. In the crystal, inversion-related molecules are linked by a slipped-parallel π–π interaction [intercentroid distance = 3.8942 (13) Å, interplanar distance = 3.478 (9) Å and slippage = 1.751 Å], and stack along the [101] direction. There are no other significant intermolecular interactions present.
Acta Crystallographica Section E-structure Reports Online | 2014
R. Vasanthi; D. Reuben Jonathan; K. S. Ezhilarasi; S. Sathya; G. Usha
In the title compound, C26H20O3, the pyran ring has a distorted half-chair conformation and its mean plane is inclined to the naphthalene ring system, to which it is fused, by 10.79 (9)°. The dihedral angles between the napthalene unit and the benzene and phenyl rings are 54.39 (9) and 52.65 (12)°, respectively, while the benzene and phenyl rings are inclined to one another by 74.80 (14)°. There is a short C—H⋯O contact in the chromen-1-one unit. In the crystal, molecules are linked by two pairs of C—H⋯O hydrogen bonds, forming inversion dimers described by graph set motifs R 2 2(8) and R 2 2(10), giving rise to chains running parallel to (101). The chains are linked via C—H⋯π interactions, forming sheets lying parallel to (010).
Acta Crystallographica Section E-structure Reports Online | 2014
S. Sathya; D. Reuben Jonathan; K. Prathebha; J. Jovita; G. Usha
In the title compound, C23H18O4, the methoxybenzene ring and attached C=C grouping are disordered over two sets of sites in a 0.823 (5):0.177 (5) ratio. The dihedral angles between the central benzene ring and the pendant phenyl and methoxybenzene ring (major orientation) are 51.21 (1) and 51.6 (1)°, respectively. In the crystal, inversion dimers linked by pairs of C—H⋯O hydrogen bonds generate R 2 2(28) loops.
Acta Crystallographica Section E: Crystallographic Communications | 2015
B. K. Revathi; D. Reuben Jonathan; K. Kalai Sevi; Kaliyaperumal Dhanalakshmi; Govindasamy Usha
The title compound, C13H16ClNO2, crystallized with two independent molecules in the asymmetric unit (A and B). The piperidinol ring in molecule B is disordered over two positions with a site occupancy ratio of 0.667 (5):0.333 (5). In both molecules these rings have a chair conformation, including the minor component in molecule B. Their mean planes are inclined to the benzene ring by 45.57 (13)° in molecule A, and by 50.5 (4)° for the major component of the piperidine ring in molecule B. In the crystal, the individual molecules are linked by O—H⋯O hydrogen bonds, forming chains of A and B molecules along the [100] direction. The chains are interlinked by C—H⋯O hydrogen bonds, forming ribbons.
Acta Crystallographica Section E: Crystallographic Communications | 2015
B. K. Revathi; D. Reuben Jonathan; K. Kalai Sevi; K. Dhanalakshmi; G. Usha
The title compound, C13H14NO2F3, crystallises with two molecules, A and B, in the asymmetric unit, with similar conformations. The dihedral angles between the piperidine and phenyl rings are 83.76 (2) and 75.23 (2)° in molecules A and B, respectively. The bond-angle sums around the N atoms [359.1 and 359.7° for molecules A and B, respectively] indicate sp 2 hybridization for these atoms. In the crystal, O—H⋯O hydrogen bonds link the molecules into separate [100] chains of A and B molecules. The chains are cross-linked by C—H⋯O interactions, generating alternating (001) sheets of A and B molecules.
Acta Crystallographica Section E: Crystallographic Communications | 2015
R. Vasanthi; D. Reuben Jonathan; K. S. Elizhlarasi; B. K. Revathi; G. Usha
In the title compound, C20H16O3, the hydropyran ring adopts a distorted half-chair conformation with the methine C atom and the ring O atom displaced by −0.554 (2) and 0.158 (1) Å, respectively, from the plane of the other four atoms (r.m.s. deviation = 0.020 Å). Its mean plane (all atoms) is inclined to the naphthalene ring system at a dihedral angle of 11.67 (1)°. The dihedral angle between the napthalene ring system and the phenyl ring is 71.84 (1)°. In the crystal, no diectional interactions beyond van der Waals contacts could be identified.
Acta Crystallographica Section E: Crystallographic Communications | 2015
B. K. Revathi; D. Reuben Jonathan; K. Kalai Sevi; K. Dhanalakshmi; G. Usha
In the title compound, C13H17NO2, the dihedral angle between the planes of the piperidine and benzene rings is 51.7 (2)°. The bond-angle sum around the N atom [359.8 (3)°] indicates sp 2 hybridization of the atom. In the crystal, O—H⋯O hydrogen bonds link the molecules, forming chains along [001].
Acta Crystallographica Section E: Crystallographic Communications | 2015
B. K. Revathi; D. Reuben Jonathan; K. Kalai Sevi; K. Dhanalakshmi; G. Usha
In the title compound, 0.75C12H14ClNO2·0.25C12H14ClNO, which is an adduct comprising 0.75 4-hydroxypiperidin-1-yl or 0.25 4-piperidin-1-yl substituents on a common (4-chlorophenyl)methanone component; the dihedral angles between the benzene ring and the two piperidine rings are 51.6 (3) and 89.5 (7)°, respectively. The hydroxypiperidine ring is in a bisectional oriention (bi) with the phenyl ring. In the crystal, intermolecular O—H⋯O hydrogen bonds between the hydroxypiperidine group and the keto O atom lead to the formation of chains extending along the c- axis direction.
Acta Crystallographica Section E: Crystallographic Communications | 2015
S. Sathya; D. Reuben Jonathan; J. Sidharthan; R. Vasanthi; G. Usha
5-(4-Benzyloxyphenyl)-3-(4-methoxyphenyl)-6-methylcyclohex-2-en-1-one crystallized with two independent molecules in the asymmetric unit. The cyclohexene ring adopts an envelope conformation in both molecules, with the C atom to which is attached the central benzene ring as the flap. The crystal packing, is stabilized by C—H⋯π interactions.