Crystallography Open Database

Information card for entry 7702481

Preview

Coordinates	7702481.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H62 Cl20 D6 N2 Ni O2 P2
Calculated formula	C68 H62 Cl20 D6 N2 Ni O2 P2
Title of publication	Synthesis and characterization of bulky salen-type complexes of Co, Cu, Fe, Mn and Ni with amphiphilic solubility properties
Authors of publication	Haikarainen, Anssi; Sipilä, Jussi; Pietikäinen, Pekka; Pajunen, Aarne; Mutikainen, Ilpo
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	7
Pages of publication	991
a	13.41 ± 0.008 Å
b	13.047 ± 0.008 Å
c	45.995 ± 0.014 Å
α	90°
β	93.39 ± 0.04°
γ	90°
Cell volume	8033 ± 7 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	8
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	0.4126
Residual factor for significantly intense reflections	0.1524
Weighted residual factors for all reflections	0.3423
Weighted residual factors for significantly intense reflections	0.2567
Weighted residual factors for all reflections included in the refinement	0.3423
Goodness-of-fit parameter for all reflections	0.876
Goodness-of-fit parameter for all reflections included in the refinement	0.876
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
243877 (current)	2019-11-28	cif/ Adding structures of 7702480, 7702481 via cif-deposit CGI script.	7702481.cif