Crystallography Open Database

Information card for entry 8105525

Preview

Coordinates	8105525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H38 Co3 N4 O12
Calculated formula	C44 H38 Co3 N4 O12
Title of publication	Synthesis and crystal structure of bis(μ2-acetato-κ2 O:O′)–bis(μ2–(8-(2-oxidophenyl)-3,6-dioxa-2,7-diazaocta-1,7-dien-1-yl)naphthalen-2-olato-κ6 O:O,N,N′,O′:O′)tricobalt(II), C44H38Co3N4O12
Authors of publication	Ren, Zong-Li; Mu, Hao-Ran; An, Xiao-Xin; Peng, Yun-Dong; Dong, Wen-Kui
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	234
Journal issue	1
Pages of publication	15 - 17
a	16.1982 ± 0.0008 Å
b	14.1334 ± 0.0007 Å
c	18.7433 ± 0.0011 Å
α	90°
β	107.916 ± 0.006°
γ	90°
Cell volume	4082.9 ± 0.4 Å³
Cell temperature	173 ± 0.1 K
Ambient diffraction temperature	173 ± 0.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1029
Residual factor for significantly intense reflections	0.0639
Weighted residual factors for significantly intense reflections	0.1323
Weighted residual factors for all reflections included in the refinement	0.1538
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
276277 (current)	2022-06-27	cif/ Adding structures of 8105525 via cif-deposit CGI script.	8105525.cif