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X-ray powder diffraction data for 2-[((3R)-5-oxo-4-phenyltetrahy drofuran-3-yl)methyl]isoindoline-1,3-dione, C19H15NO4

Published online by Cambridge University Press:  01 April 2016

Shoujun Zheng ,
Kailin Xu ,
Qing Wang ,
XiaoLin Tang ,
Yanmei Huang ,
Pei Xiao Tang ,
Lijuan Chen  and
Hui Li
Shoujun Zheng
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
Kailin Xu
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
Qing Wang
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
XiaoLin Tang
Affiliation:
Sichuan CheCO Pharmaceutical Technology Co., Ltd., Chengdu 610041, China
Yanmei Huang
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
Pei Xiao Tang
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
Lijuan Chen
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
Hui Li*
Affiliation:
College of Chemical Engineering, Sichuan University, Chengdu 610065, China
*
a)Author to whom correspondence should be addressed. Electronic mail: lihuilab@sina.com
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Abstract

2-[((3R)-5-oxo-4-phenyltetrahydrofuran-3-yl)methyl]isoindoline-1,3-dione, C19H15NO4, was synthesized for the first time. Its structure was characterized by element analysis, ultraviolet spectrometry, nuclear magnetic resonance, and single X-ray diffraction (SXRD). X-ray powder diffraction (XRPD) data of title compound were collected and calculated. The result of SXRD shows that its crystal system is orthorhombic, space group is Pbca, and unit-cell parameters are a = 8.861 57(7), b = 14.6666(10), c = 24.4247(19) Å, α =β =γ =90°, unit-cell volume V = 3174.4 Å3, and Z = 8. All XRPD measured lines were indexed and consistent with the Pbca space group [a = 14.639(7), b = 24.378(3), c = 8.918(1) Å, α = β = γ = 90°, unit-cell volume V = 3182.7(9) Å3, Z = 8]. No detectable impurities were observed.

Keywords

X-ray powder diffraction2-[((3R)-5-oxo-4-phenyltetrahy drofuran-3-yl)methyl]isoindoline-1,3-dioneMilnacipran hydrochloride
Type
New Diffraction Data
Information
Powder Diffraction , Volume 31 , Issue 2 , June 2016 , pp. 155 - 158
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Copyright
Copyright © International Centre for Diffraction Data 2016 

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