Crystallography Open Database

Information card for entry 7700447

Preview

Coordinates	7700447.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H37 Au B Cl N6 O2 Se Si W
Calculated formula	C38 H37 Au B Cl N6 O2 Se Si W
Title of publication	Auriferous alkynylselenolatoalkylidynes.
Authors of publication	Frogley, Benjamin J.; Hill, Anthony F.; Onn, Chee S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	31
Pages of publication	11715 - 11723
a	18.8932 ± 0.0003 Å
b	10.8591 ± 0.0002 Å
c	19.9439 ± 0.0003 Å
α	90°
β	103.018 ± 0.001°
γ	90°
Cell volume	3986.59 ± 0.12 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	10
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0564
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.119
Weighted residual factors for all reflections included in the refinement	0.1303
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
224358 (current)	2019-11-08	cif/ Updating files of 7700440, 7700441, 7700442, 7700443, 7700444, 7700445, 7700446, 7700447 Original log message: Adding full bibliography for 7700440--7700447.cif.	7700447.cif
216763	2019-07-05	cif/ Adding structures of 7700440, 7700441, 7700442, 7700443, 7700444, 7700445, 7700446, 7700447 via cif-deposit CGI script.	7700447.cif