Synthesis and Crystal Structure of 2‐(Dichloromethyl)‐2‐(4‐nitrophenyl)‐1,3‐dioxane
Author(s) -
Fei Ye,
Chang-Ying Sun,
Ying Fu
Publication year - 2013
Publication title -
journal of chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.436
H-Index - 50
eISSN - 2090-9063
pISSN - 2090-9071
DOI - 10.1155/2013/974174
Subject(s) - chemistry , monoclinic crystal system , crystal structure , crystallography , crystal (programming language) , group (periodic table) , stereochemistry , organic chemistry , computer science , programming language
A new compound, 2-dichloromethyl-2-p-nitrophenyl-1,3-dioxane, was synthesized and characterized. The crystal structure of the title compound (C11H11Cl2NO4, Mr=292.11) has been determined by single-crystal X-ray diffraction. The crystal is of monoclinic, space group P21/c with a=11.013(2) Å, b=14.653(3) Å, c=7.8693(16) Å, α=90°, β=97.06(3)°, γ=90°, V=1260.3(4) Å3, Z=4, F(000)=600, Dc=1.540 mg/cm3, the final R1=0.0508, and ωR2=0.1072 for observed reflections with I>2σI. A total of 12162 reflections were collected, of which 2867 were unique (Rint=0.06999)
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