Crystallography Open Database

Information card for entry 4021427

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Coordinates	4021427.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H53 O6
Calculated formula	C43 H53 O6
Title of publication	Synthesis of Oligophenylene-Substituted Calix[4]crown-4s and Their Silver(I) Ion-Induced Nanocones Formation
Authors of publication	Man Shing Wong; Ping Fang Xia; Pik Kwan Lo; Xiao Hua Sun; Wai Yeung Wong; Shaomin Shuang
Journal of publication	Journal of Organic Chemistry
Year of publication	2006
Journal volume	71
Pages of publication	940 - 946
a	18.6014 ± 0.0008 Å
b	19.2511 ± 0.0009 Å
c	10.3718 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	3714.1 ± 0.3 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	3
Space group number	34
Hermann-Mauguin space group symbol	P n n 2
Hall space group symbol	P 2 -2n
Residual factor for all reflections	0.075
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1724
Weighted residual factors for all reflections included in the refinement	0.1911
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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