Crystallography Open Database

Information card for entry 7217024

Preview

Coordinates	7217024.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H46 N4 Ni O8 P2 S4
Calculated formula	C42 H46 N4 Ni O8 P2 S4
Title of publication	Stereospecific generation of homochiral helices in coordination polymers built from enantiopure binaphthyl-based ligands
Authors of publication	Crespo Alonso, M.; Arca, M.; Isaia, F.; Lai, R.; Lippolis, V.; Callear, S. K.; Caricato, M.; Pasini, D.; Coles, S. J.; Aragoni, M. C.
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	36
Pages of publication	8582
a	15.332 ± 0.002 Å
b	8.6055 ± 0.001 Å
c	34.795 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	4590.8 ± 1 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.2125
Residual factor for significantly intense reflections	0.1495
Weighted residual factors for significantly intense reflections	0.2815
Weighted residual factors for all reflections included in the refinement	0.3147
Goodness-of-fit parameter for all reflections included in the refinement	1.162
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
180501 (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 7/21/70.	7217024.cif
123398	2014-09-08	cif/ Updating files of 7217023, 7217024 Original log message: Adding full bibliography for 7217023--7217024.cif.	7217024.cif
119004	2014-07-05	cif/ Adding structures of 7217023, 7217024 via cif-deposit CGI script.	7217024.cif