Crystallography Open Database

Information card for entry 4021277

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Structure parameters

Formula	C42 H37 N5 O8
Calculated formula	C42 H37 N5 O8
SMILES	n1c(cc(cc1c1ncccc1)COC(=O)c1cc(c(c(c1)NC(=O)c1cc(cc(c1)OC)OC)C)NC(=O)c1cc(cc(c1)OC)OC)c1ncccc1
Title of publication	A Convenient Protocol for the Synthesis of Ligands from a 4-Methyl-3,5-diacylaminophenyl Platform
Authors of publication	Guillaume Pickaert; Michèle Cesario; Raymond Ziessel
Journal of publication	Journal of Organic Chemistry
Year of publication	2004
Journal volume	69
Pages of publication	5335 - 5341
a	8.809 ± 0.003 Å
b	12.032 ± 0.005 Å
c	16.928 ± 0.006 Å
α	79.47 ± 0.03°
β	86.76 ± 0.03°
γ	82.48 ± 0.03°
Cell volume	1747.9 ± 1.1 Å³
Cell temperature	177 ± 2 K
Ambient diffraction temperature	177 ± 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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