Crystallography Open Database

Information card for entry 4321170

Preview

Coordinates	4321170.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H40 N12 Ni O7
Calculated formula	C37 H40 N12 Ni O7
Title of publication	Synthesis, Characterization, and Spontaneous Resolution of Chiral Nickel(II) Complexes with the Tripod Ligand Tris[2-(((2-phenylimidazol-4-yl)methylidene)amino)ethyl]amine
Authors of publication	Ikuko Katsuki; Naohide Matsumoto; Masaaki Kojima
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	3350 - 3354
a	14.198 ± 0.002 Å
b	22.422 ± 0.002 Å
c	12.019 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3826.2 ± 0.9 Å³
Cell temperature	293.2 K
Ambient diffraction temperature	293.2 K
Number of distinct elements	5
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	0.0452
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.0455
Weighted residual factors for all reflections included in the refinement	0.0429
Goodness-of-fit parameter for all reflections included in the refinement	0.974
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4321170.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4321170.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4321170.cif
18519	2011-05-01	../uploads/cif-deposit/cod/cif Adding structures of 4321170 via cif-deposit CGI script.	4321170.cif