Crystallography Open Database

Information card for entry 7714500

Preview

Coordinates	7714500.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H62 N6 Ni2 O7
Calculated formula	C66 H62 N6 Ni2 O7
Title of publication	Bimetallic nickel complexes containing imidazole-based phenolate ligands as efficient catalysts for the copolymerization of carbon dioxide with epoxides.
Authors of publication	Hsu, Han-Fang; Liu, Guan-Lin; Su, Yu-Chia; Ko, Bao-Tsan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	53
Journal issue	1
Pages of publication	299 - 314
a	12.5633 ± 0.0011 Å
b	32.882 ± 0.003 Å
c	14.9737 ± 0.0012 Å
α	90°
β	107.869 ± 0.003°
γ	90°
Cell volume	5887.3 ± 0.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	149.76 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1125
Residual factor for significantly intense reflections	0.0985
Weighted residual factors for significantly intense reflections	0.2226
Weighted residual factors for all reflections included in the refinement	0.2285
Goodness-of-fit parameter for all reflections included in the refinement	1.265
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
289463 (current)	2024-02-04	cif/ Updating files of 7714500, 7714501, 7714502, 7714503, 7714504, 7714505, 7714506, 7714507, 7714508, 7714509 Original log message: Adding full bibliography for 7714500--7714509.cif.	7714500.cif
287688	2023-11-19	cif/ Adding structures of 7714500, 7714501, 7714502, 7714503, 7714504, 7714505, 7714506, 7714507, 7714508, 7714509 via cif-deposit CGI script.	7714500.cif