Crystallography Open Database

Information card for entry 4021017

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Coordinates	4021017.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C95 H128 N11 O13
Calculated formula	C95 H119 N11 O13
Title of publication	A novel C~3v~-Symmetrical Calix[6](aza)cryptand with a Remarkably High and Selective Affinity for Small Ammoniums
Authors of publication	Ulrich Darbost; Michel Giorgi; Olivia Reinaud; Ivan Jabin
Journal of publication	Journal of Organic Chemistry
Year of publication	2004
Journal volume	69
Pages of publication	4879 - 4884
a	16.0412 ± 0.0003 Å
b	16.462 ± 0.0006 Å
c	19.5672 ± 0.0007 Å
α	92.048 ± 0.002°
β	96.881 ± 0.002°
γ	112.039 ± 0.002°
Cell volume	4736.6 ± 0.3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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