Crystallography Open Database

Information card for entry 7048593

Preview

Coordinates	7048593.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 O3 S2
Calculated formula	C24 H26 O3 S2
Title of publication	A non-symmetric sulfur-based O,C,O-chelating pincer ligand leading to chiral germylene and stannylene.
Authors of publication	Deak, Noemi; Thillaye du Boullay, Olivier; Moraru, Ionut-Tudor; Mallet-Ladeira, Sonia; Madec, David; Nemes, Gabriela
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	7
Pages of publication	2399 - 2406
a	9.035 ± 0.004 Å
b	9.959 ± 0.004 Å
c	13.309 ± 0.01 Å
α	100.829 ± 0.017°
β	101.45 ± 0.03°
γ	102.442 ± 0.015°
Cell volume	1112.4 ± 1.1 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 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	0.0553
Residual factor for significantly intense reflections	0.0475
Weighted residual factors for significantly intense reflections	0.1095
Weighted residual factors for all reflections included in the refinement	0.1129
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
224311 (current)	2019-11-08	cif/ Updating files of 7048592, 7048593, 7048594, 7048595 Original log message: Adding full bibliography for 7048592--7048595.cif.	7048593.cif
213033	2019-01-13	cif/ Adding structures of 7048592, 7048593, 7048594, 7048595 via cif-deposit CGI script.	7048593.cif