Crystallography Open Database

Information card for entry 7716743

Preview

Coordinates	7716743.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H104 Cl8 F12 N8 Ni2 O4 Sb2
Calculated formula	C81 H98 Cl2 F12 N8 Ni2 O4 Sb2
Title of publication	Ni(II) and Pd(II) complexes of a new redox-active pentadentate azo-appended 2-aminophenol ligand: Pd(II)-assisted intraligand cyclization forms a phenoxazinyl ring.
Authors of publication	Bhowmik, Saumitra; Sengupta, Arunava; Mukherjee, Rabindranath
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	33
Pages of publication	14046 - 14064
a	9.5233 ± 0.0014 Å
b	18.212 ± 0.003 Å
c	27.463 ± 0.004 Å
α	81.734 ± 0.004°
β	83.363 ± 0.004°
γ	85.055 ± 0.004°
Cell volume	4670.3 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0513
Residual factor for significantly intense reflections	0.0385
Weighted residual factors for significantly intense reflections	0.0903
Weighted residual factors for all reflections included in the refinement	0.0983
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
294562 (current)	2024-09-06	cif/ Updating files of 7716740, 7716741, 7716742, 7716743 Original log message: Adding full bibliography for 7716740--7716743.cif.	7716743.cif
293548	2024-07-26	cif/ Adding structures of 7716740, 7716741, 7716742, 7716743 via cif-deposit CGI script.	7716743.cif