Crystallography Open Database

Information card for entry 7049769

Preview

Coordinates	7049769.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H29 B F4 P Sb
Calculated formula	C36 H29 B F4 P Sb
Title of publication	Phosphonium-stibonium and bis-stibonium cations as pnictogen-bonding catalysts for the transfer hydrogenation of quinolines.
Authors of publication	Yang, Mengxi; Hirai, Masato; Gabbaï, François P
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	20
Pages of publication	6685 - 6689
a	10.9669 ± 0.0005 Å
b	22.7967 ± 0.001 Å
c	13.263 ± 0.0006 Å
α	90°
β	111.988 ± 0.002°
γ	90°
Cell volume	3074.7 ± 0.2 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	6
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	0.0726
Residual factor for significantly intense reflections	0.0436
Weighted residual factors for significantly intense reflections	0.0983
Weighted residual factors for all reflections included in the refinement	0.1108
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	No
Has F_obs	No

Version history

Revision	Date	Message	Files
224219 (current)	2019-11-08	cif/ Updating files of 7049767, 7049768, 7049769 Original log message: Adding full bibliography for 7049767--7049769.cif.	7049769.cif
214694	2019-04-19	cif/ Adding structures of 7049767, 7049768, 7049769 via cif-deposit CGI script.	7049769.cif