Crystallography Open Database

Information card for entry 7713251

Preview

Coordinates	7713251.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H29 O2 Sb
Calculated formula	C25 H29 O2 Sb
SMILES	[Sb]1(O[C@@H]([C@@H](O1)C)C)(c1ccc(cc1)C)(c1ccc(cc1)C)c1ccc(cc1)C
Title of publication	Models of the putative antimony(V)-diolate motifs in antileishmanial pentavalent antimonial drugs.
Authors of publication	Lindquist-Kleissler, Brent; Johnstone, Timothy C.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
a	8.6242 ± 0.0002 Å
b	9.3045 ± 0.0002 Å
c	14.1213 ± 0.0003 Å
α	79.804 ± 0.002°
β	83.183 ± 0.002°
γ	80.822 ± 0.002°
Cell volume	1096.19 ± 0.04 Å³
Cell temperature	101 ± 1 K
Ambient diffraction temperature	101 ± 1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0321
Residual factor for significantly intense reflections	0.031
Weighted residual factors for significantly intense reflections	0.0817
Weighted residual factors for all reflections included in the refinement	0.0825
Goodness-of-fit parameter for all reflections included in the refinement	1.101
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
284608 (current)	2023-06-29	cif/ Adding structures of 7713246, 7713247, 7713248, 7713249, 7713250, 7713251, 7713252, 7713253 via cif-deposit CGI script.	7713251.cif