Crystallography Open Database





Information card for 7015458

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Coordinates

7015458.cif

Structure parameters

Formula - C46 H48 N6 O6 -
Calculated formula - C46 H44 N6 O6 -
Title of publication Methoxy-substituted isoTQEN family for enhanced fluorescence response toward zinc ion.
Authors of publication Mikata, Yuji; Yamashita, Azusa; Kawata, Keiko; Konno, Hideo; Itami, Saori; Yasuda, Keiko; Tamotsu, Satoshi
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 16
Pages of publication 4059 - 4066
a 7.719 ± 0.003 Å
b 10.624 ± 0.004 Å
c 12.707 ± 0.004 Å
α 94.471 ± 0.005°
β 92.306 ± 0.005°
γ 97.157 ± 0.005°
Cell volume 1029.5 ± 0.6 Å3
Cell temperature 173 K
Ambient diffraction temperature 173 K
Number of distinct elements 4
Hermann-Mauguin symmetry space group P -1
Hall symmetry space group -P 1
Residual factor for observed reflections 0.0541
Weighted residual factors for all reflections included in the refinement 0.1643
Goodness-of-fit parameter for observed reflections 1.077
Diffraction radiation wavelength 0.7107 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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