Crystallography Open Database

Information card for entry 7121489

Preview

Coordinates	7121489.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H14 N3 O6 Re S2
Calculated formula	C15 H14 N3 O6 Re S2
Title of publication	Synthesis, characterization and biological evaluation of Pd(ii), Cu(ii), Re(i) and <sup>99m</sup>Tc(i) thiazole-based complexes.
Authors of publication	Mašković, Jelena M; Hatzidimitriou, Antonios; Damjanović, Ana; Stanojković, Tatjana P; Trifunović, Srećko R; Geronikaki, Athina A.; Papagiannopoulou, Dionysia
Journal of publication	MedChemComm
Year of publication	2018
Journal volume	9
Journal issue	5
Pages of publication	831 - 842
a	26.3056 ± 0.0013 Å
b	9.4798 ± 0.0004 Å
c	16.1346 ± 0.0006 Å
α	90°
β	106.786 ± 0.002°
γ	90°
Cell volume	3852.1 ± 0.3 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 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 all reflections	0.0741
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for all reflections	0.0601
Weighted residual factors for significantly intense reflections	0.0538
Weighted residual factors for all reflections included in the refinement	0.0538
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation probe	x-ray
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
230131 (current)	2019-11-17	cif/ Updating files of 7121489, 7121490 Original log message: Adding full bibliography for 7121489--7121490.cif.	7121489.cif
207335	2018-04-14	cif/ Adding structures of 7121489, 7121490 via cif-deposit CGI script.	7121489.cif