Crystallography Open Database

Information card for entry 7028338

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Coordinates	7028338.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H42 Cl2 N6 O11 Zn
Calculated formula	C39 H42 Cl2 N6 O11 Zn
Title of publication	Quinoline-attached triazacyclononane (TACN) derivatives as fluorescent zinc sensors.
Authors of publication	Mikata, Yuji; Nodomi, Yuki; Kizu, Asako; Konno, Hideo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	4
Pages of publication	1684 - 1690
a	9.7431 ± 0.0004 Å
b	37.9514 ± 0.0011 Å
c	11.4609 ± 0.0004 Å
α	90°
β	112.976 ± 0.0017°
γ	90°
Cell volume	3901.6 ± 0.2 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for all reflections included in the refinement	0.0953
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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