Crystallography Open Database

Information card for entry 7704336

Preview

Coordinates	7704336.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H41 Au N P S2
Calculated formula	C27 H41 Au N P S2
Title of publication	Highly cytotoxic gold(i)-phosphane dithiocarbamate complexes trigger an ER stress-dependent immune response in ovarian cancer cells.
Authors of publication	Le, Hai Van; Babak, Maria V.; Ehsan, Muhammad Ali; Altaf, Muhammad; Reichert, Lisa; Gushchin, Artem L.; Ang, Wee Han; Isab, Anvarhusein A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	22
Pages of publication	7355 - 7363
a	10.9925 ± 0.0004 Å
b	13.0068 ± 0.0004 Å
c	19.473 ± 0.0006 Å
α	90°
β	97.212 ± 0.0013°
γ	90°
Cell volume	2762.17 ± 0.16 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0285
Residual factor for significantly intense reflections	0.0248
Weighted residual factors for significantly intense reflections	0.0569
Weighted residual factors for all reflections included in the refinement	0.0583
Goodness-of-fit parameter for all reflections included in the refinement	1.118
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
253880 (current)	2020-07-06	cif/ Updating files of 7704333, 7704334, 7704335, 7704336 Original log message: Adding full bibliography for 7704333--7704336.cif.	7704336.cif
251922	2020-05-08	cif/ Adding structures of 7704333, 7704334, 7704335, 7704336 via cif-deposit CGI script.	7704336.cif