Crystal and molecular structure of desmodin

A. Abdul Ajees; K. Sekar; S. Parthasarathy; K. Balakrishna

doi:10.1002/1521-4079(200009)35:9<1117::AID-CRAT1117>3.0.CO;2-3

Crystal and molecular structure of desmodin

A. Abdul Ajees, K. Sekar, S. Parthasarathy, K. Balakrishna

Manipal Institute of Applied Physics (MIAP)

Research output: Contribution to journal › Article › peer-review

3 Citations (Scopus)

Abstract

The crystal structure of the title compound has been determined from X-ray diffraction. The compound crystallizes from benzene in the orthorhombic system, space group P2₁2₁2₁, with unit cell parameters: a = 8.485(2), b = 9.816(2), c = 22.597(4) angstroms, Z = 4, V = 1881.9(7) angstroms³. The structure was determined by direct methods and refined to a final R-factor of 0.04. Six membered rings B and E are planar. Ring A and ring C are in slightly distorted sofa conformation. Ring D is in envelope conformation. The structure is stabilized by weak intermolecular C-H...O hydrogen bonds.

Original language	English
Pages (from-to)	1117-1123
Number of pages	7
Journal	Crystal Research and Technology
Volume	35
Issue number	9
DOIs	https://doi.org/10.1002/1521-4079(200009)35:9<1117::AID-CRAT1117>3.0.CO;2-3
Publication status	Published - 01-12-2000

All Science Journal Classification (ASJC) codes

General Chemistry
General Materials Science
Condensed Matter Physics

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10.1002/1521-4079(200009)35:9<1117::AID-CRAT1117>3.0.CO;2-3

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title = "Crystal and molecular structure of desmodin",

abstract = "The crystal structure of the title compound has been determined from X-ray diffraction. The compound crystallizes from benzene in the orthorhombic system, space group P212121, with unit cell parameters: a = 8.485(2), b = 9.816(2), c = 22.597(4) angstroms, Z = 4, V = 1881.9(7) angstroms3. The structure was determined by direct methods and refined to a final R-factor of 0.04. Six membered rings B and E are planar. Ring A and ring C are in slightly distorted sofa conformation. Ring D is in envelope conformation. The structure is stabilized by weak intermolecular C-H...O hydrogen bonds.",

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T1 - Crystal and molecular structure of desmodin

AU - Ajees, A. Abdul

AU - Sekar, K.

AU - Parthasarathy, S.

AU - Balakrishna, K.

PY - 2000/12/1

Y1 - 2000/12/1

N2 - The crystal structure of the title compound has been determined from X-ray diffraction. The compound crystallizes from benzene in the orthorhombic system, space group P212121, with unit cell parameters: a = 8.485(2), b = 9.816(2), c = 22.597(4) angstroms, Z = 4, V = 1881.9(7) angstroms3. The structure was determined by direct methods and refined to a final R-factor of 0.04. Six membered rings B and E are planar. Ring A and ring C are in slightly distorted sofa conformation. Ring D is in envelope conformation. The structure is stabilized by weak intermolecular C-H...O hydrogen bonds.

AB - The crystal structure of the title compound has been determined from X-ray diffraction. The compound crystallizes from benzene in the orthorhombic system, space group P212121, with unit cell parameters: a = 8.485(2), b = 9.816(2), c = 22.597(4) angstroms, Z = 4, V = 1881.9(7) angstroms3. The structure was determined by direct methods and refined to a final R-factor of 0.04. Six membered rings B and E are planar. Ring A and ring C are in slightly distorted sofa conformation. Ring D is in envelope conformation. The structure is stabilized by weak intermolecular C-H...O hydrogen bonds.

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Crystal and molecular structure of desmodin

Abstract

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