Crystallography Open Database

Information card for entry 7250894

Preview

Coordinates	7250894.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H31 Br N5 O7 Re
Calculated formula	C24 H31 Br N5 O7 Re
Title of publication	Synthesis, characterization, DNA interaction, and anticancer studies of novel facial tricarbonylrhenium(i) complexes with uracil-derived ligands
Authors of publication	Abdullah, Shabaaz; Davison, Candace; Smit, Christie Jane; Mbatha, Phiwokuhle; Mare, Jo-Anne de la; Booysen, Irvin Noel
Journal of publication	RSC Advances
Year of publication	2025
Journal volume	15
Journal issue	41
Pages of publication	34635 - 34642
a	18.9342 ± 0.001 Å
b	10.194 ± 0.0005 Å
c	28.1709 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	5437.4 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0411
Residual factor for significantly intense reflections	0.0279
Weighted residual factors for significantly intense reflections	0.0502
Weighted residual factors for all reflections included in the refinement	0.0548
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
302221 (current)	2025-09-23	cif/ Adding structures of 7250892, 7250893, 7250894 via cif-deposit CGI script.	7250894.cif