Crystallography Open Database

Information card for entry 7719867

7719866 << 7719867 >> 7719868

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Coordinates	7719867.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	23dece
Formula	C56 H56 Cl5 N3 O P2 Ru
Calculated formula	C56 H56 Cl5 N3 O P2 Ru
Title of publication	Hemiparetic koneramine NNP ligand comprising strategic hard and soft donors: transition metal complexes, CS<sub>2</sub> activation and therapeutic potential.
Authors of publication	Yadav, Archana; Dewan, Sayari; Chaudhary, Kajal; Butcher, Ray J.; Singh, Ritika Gautam; Angamuthu, Raja
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	47
Pages of publication	17471 - 17478
a	19.123 ± 0.004 Å
b	13.942 ± 0.003 Å
c	20.518 ± 0.004 Å
α	90°
β	109.988 ± 0.006°
γ	90°
Cell volume	5140.9 ± 1.9 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.0855
Weighted residual factors for all reflections included in the refinement	0.1071
Goodness-of-fit parameter for all reflections included in the refinement	1.118
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
304105 (current)	2025-12-07	cif/ Updating files of 7719864, 7719865, 7719866, 7719867, 7719868, 7719869, 7719870, 7719871, 7719872, 7719873, 7719874, 7719875, 7719876 Original log message: Adding full bibliography for 7719863--7719876.cif.	7719867.cif
303271	2025-11-12	cif/ Adding structures of 7719863, 7719864, 7719865, 7719866, 7719867, 7719868, 7719869, 7719870, 7719871, 7719872, 7719873, 7719874, 7719875, 7719876 via cif-deposit CGI script.	7719867.cif