Crystallography Open Database

Information card for entry 7701893

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Structure parameters

Formula	C24 H26 Ce N13 O13
Calculated formula	C24 H26 Ce N13 O13
Title of publication	A Ce(III) complex potently inhibits the activity and expression of tyrosine phosphatase SHP-2
Authors of publication	Lin, Lixia; Lu, Liping; Du, Ran; Yuan, Caixia; Zhu, Miaoli; Fu, Xueqi; Xing, Shu
Journal of publication	Dalton Transactions
Year of publication	2019
a	23.8474 ± 0.0012 Å
b	9.3378 ± 0.0005 Å
c	18.26 ± 0.0016 Å
α	90°
β	126.447 ± 0.0011°
γ	90°
Cell volume	3270.9 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0582
Residual factor for significantly intense reflections	0.039
Weighted residual factors for significantly intense reflections	0.0534
Weighted residual factors for all reflections included in the refinement	0.0575
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301878 (current)	2025-08-23	Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure.	7701893.cif
227753	2019-11-14	cif/ Adding structures of 7701893 via cif-deposit CGI script.	7701893.cif