Crystallography Open Database

Information card for entry 7713282

Preview

Coordinates	7713282.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	1
Formula	C27 H39 N2 O3 V
Calculated formula	C27 H39 N2 O3 V
SMILES	[V]1(OC(C)C)(OC(C)C)(=O)[n]2cccc3CCC=C(N1c1c(cccc1C(C)C)C(C)C)c23
Title of publication	Vanadium complexes bearing 8-anilide-5,6,7-trihydroquinoline ligands for ethylene (co-)polymerization.
Authors of publication	Wu, Ruiyao; Niu, Zhen; Xia, Zhu; He, Jianyun; Bai, Chenxi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2023
Journal volume	52
Journal issue	25
Pages of publication	8636 - 8644
a	18.683 ± 0.003 Å
b	14.963 ± 0.002 Å
c	19.074 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5332.2 ± 1.4 Å³
Cell temperature	100.15 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0803
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.1167
Weighted residual factors for all reflections included in the refinement	0.1381
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
284620 (current)	2023-06-29	cif/ Adding structures of 7713281, 7713282, 7713283, 7713284, 7713285 via cif-deposit CGI script.	7713282.cif