Crystallography Open Database

Information card for entry 4100688

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Coordinates	4100688.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C83 H76 Lu2 N16 O29
Calculated formula	C83 H76 Lu2 N16 O29
SMILES	[Lu]12345([n]6c(cccc6c6[n]2c2ccc(OC(=O)c7ccccc7)cc2[n]6CC)c2[n]1c1ccc(OC(=O)c6ccccc6)cc1n2CC)([O]=N(O3)=O)(ON(=[O]4)=O)ON(=[O]5)=O.O=C(C)C.O=C(C)C
Title of publication	Molecular Control of Macroscopic Cubic, Columnar and Lamellar Organizations in Luminescent Lanthanide-containing Thermotropic Liquid Crystals.
Authors of publication	Emmanuel Terazzi; Stephane Torelli; Jean-Pierre Rivera; Jean-Marc Benech; Gerald Bernardinelli; Cyril Bourgogne; Bertrand Donnio; Daniel Guillon; Daniel Imbert; Jean-Claude Bunzli; Andre Pinto; Damien Jeannerat; Claude Piguet
Journal of publication	Journal of the American Chemical Society
Year of publication	2005
a	14.8858 ± 0.0008 Å
b	15.1794 ± 0.0009 Å
c	23.6556 ± 0.0013 Å
α	93.033 ± 0.007°
β	106.13 ± 0.006°
γ	118.204 ± 0.006°
Cell volume	4416.7 ± 0.6 Å³
Cell temperature	200 K
Number of distinct elements	5
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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