Crystallography Open Database

Information card for entry 4344804

Preview

Coordinates	4344804.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H82 N2 O17
Calculated formula	C88 H82 N2 O17
Title of publication	A Molecular Chameleon with Fluorescein and Rhodamine Spectroscopic Behaviors.
Authors of publication	Li, Ling; Wang, Chunyan; Wu, Jianjian; Tse, Yu Chung; Cai, Yue-Peng; Wong, Keith Man-Chung
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	55
Journal issue	1
Pages of publication	205
a	8.2867 ± 0.0002 Å
b	9.9403 ± 0.0003 Å
c	23.3563 ± 0.0016 Å
α	89.016 ± 0.006°
β	86.264 ± 0.006°
γ	73.891 ± 0.005°
Cell volume	1844.44 ± 0.15 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1762
Residual factor for significantly intense reflections	0.1426
Weighted residual factors for significantly intense reflections	0.3483
Weighted residual factors for all reflections included in the refinement	0.3784
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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