Crystallography Open Database

Information card for entry 7714249

Preview

Coordinates	7714249.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C86 H72 B Cl F24 N3 Sb
Calculated formula	C86 H72 B Cl F24 N3 Sb
SMILES	[Sb]12(Cl)N3c4c(cc(C(C)(C)C)cc4[N]2=C(c2ccccc2)c2ccccc2)C(C)(C)c2c3c([N]1=C(c1ccccc1)c1ccccc1)cc(c2)C(C)(C)C.FC(F)(F)c1cc(cc(c1)C(F)(F)F)[B-](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(C(F)(F)F)c1)C(F)(F)F.C(CC)CC
Title of publication	Utilizing Bis(imino)dihydroacridanide Pincer Ligands in p-Block Chemistry: Synthesis and Catalysis of an Antimony Monocation Salt
Authors of publication	Lan, Xiaofang; Zhang, Xin; Mei, Yanbo; Hu, Chaopeng; Liu, Liu Leo
Journal of publication	Dalton Transactions
Year of publication	2023
a	12.0357 ± 0.0008 Å
b	15.0197 ± 0.0011 Å
c	24.7036 ± 0.0017 Å
α	91.171 ± 0.005°
β	101.962 ± 0.004°
γ	112.763 ± 0.004°
Cell volume	4003.3 ± 0.5 Å³
Cell temperature	100 ± 0.2 K
Ambient diffraction temperature	100 ± 0.2 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	0.1442
Residual factor for significantly intense reflections	0.1107
Weighted residual factors for significantly intense reflections	0.2576
Weighted residual factors for all reflections included in the refinement	0.2729
Goodness-of-fit parameter for all reflections included in the refinement	1.096
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
287023 (current)	2023-10-19	cif/ Adding structures of 7714246, 7714247, 7714248, 7714249, 7714250 via cif-deposit CGI script.	7714249.cif