Crystallography Open Database

Information card for entry 7059674

Preview

Coordinates	7059674.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H42 Cl N3 O P2 Ru
Calculated formula	C53 H42 Cl N3 O P2 Ru
Title of publication	Ruthenocycles of benzothiazolyl and pyridyl hydrazones with ancillary PAHs: synthesis, structure, electrochemistry and antimicrobial activity
Authors of publication	Dinda, Soumitra; Sultana, Tamanna; Sultana, Suhana; Patra, Sarat Chandra; Mitra, Arup Kumar; Roy, Subhadip; Pramanik, Kausikisankar; Ganguly, Sanjib
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	26
Pages of publication	11022 - 11034
a	12.7697 ± 0.0015 Å
b	14.3912 ± 0.0017 Å
c	14.5106 ± 0.0018 Å
α	103.662 ± 0.005°
β	113.28 ± 0.004°
γ	103.41 ± 0.005°
Cell volume	2216.6 ± 0.5 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0702
Residual factor for significantly intense reflections	0.0472
Weighted residual factors for significantly intense reflections	0.1373
Weighted residual factors for all reflections included in the refinement	0.1688
Goodness-of-fit parameter for all reflections included in the refinement	1.0371
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
257720 (current)	2020-10-06	cif/ Updating files of 7059673, 7059674, 7059675, 7059676 Original log message: Adding full bibliography for 7059673--7059676.cif.	7059674.cif
255066	2020-08-06	cif/ Updating files of 7059673, 7059674, 7059675, 7059676 Original log message: Adding full bibliography for 7059673--7059676.cif.	7059674.cif
252638	2020-06-04	cif/ Adding structures of 7059673, 7059674, 7059675, 7059676 via cif-deposit CGI script.	7059674.cif