Crystallography Open Database

Information card for entry 4311362

Preview

Coordinates	4311362.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H44 Cd Fe2 N2 O5
Calculated formula	C48 H44 Cd Fe2 N2 O5
Title of publication	Novel One-Dimensional Polymers Generated from p-Ferrocenylbenzoate: Syntheses, Structures, and Magnetic Properties
Authors of publication	Hongwei Hou; Linke Li; Yu Zhu; Yaoting Fan; Yuqin Qiao
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	4767 - 4774
a	9.0012 ± 0.0018 Å
b	12.354 ± 0.003 Å
c	19.981 ± 0.004 Å
α	93.79 ± 0.03°
β	96.53 ± 0.03°
γ	106.03 ± 0.03°
Cell volume	2110.6 ± 0.9 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0776
Residual factor for significantly intense reflections	0.0489
Weighted residual factors for significantly intense reflections	0.1196
Weighted residual factors for all reflections included in the refinement	0.1289
Goodness-of-fit parameter for all reflections included in the refinement	0.982
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4311362.html