Crystallography Open Database

Information card for entry 7214242

Preview

Coordinates	7214242.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82.69 H73.38 Au2 Cl9.38 N2 O8 P4
Calculated formula	C82.692 H73.384 Au2 Cl9.384 N2 O8 P4
Title of publication	A stimuli-responsive double-stranded digold(i) helicate
Authors of publication	Jobbágy, Csaba; Molnár, Miklós; Baranyai, Péter; Hamza, Andrea; Pálinkás, Gábor; Deák, Andrea
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	15
Pages of publication	3192
a	28.247 ± 0.005 Å
b	18.297 ± 0.004 Å
c	18.992 ± 0.004 Å
α	90°
β	121.566 ± 0.008°
γ	90°
Cell volume	8363 ± 3 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0702
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.0617
Weighted residual factors for all reflections included in the refinement	0.079
Goodness-of-fit parameter for all reflections included in the refinement	0.718
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
180473 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/42.	7214242.cif
108272	2014-03-30	cif/ Adding structures of 7214241, 7214242, 7214243, 7214244 via cif-deposit CGI script.	7214242.cif