Crystallography Open Database

Information card for entry 7702597

Preview

Coordinates	7702597.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H58 Cu4 N8 O21
Calculated formula	C32 H40 Cu4 N8 O21
Title of publication	Supramolecular architectures from the self-assembly of trans-oxamidato-bridged dicopper(II) building blocks and phenyldicarboxylates
Authors of publication	Zhang, Hua-Xin; Kang, Bei-Sheng; Xu, An-Wu; Chen, Zhong-Ning; Zhou, Zhong-Yuan; Chan, Albert S. C.; Yu, Kai-Bei; Ren, Chen
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	18
Pages of publication	2559
a	9.38 ± 0.001 Å
b	20.613 ± 0.002 Å
c	12.093 ± 0.001 Å
α	90°
β	104.27 ± 0.01°
γ	90°
Cell volume	2266 ± 0.4 Å³
Cell temperature	290 ± 2 K
Ambient diffraction temperature	290 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.05
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for all reflections	0.0881
Weighted residual factors for significantly intense reflections	0.0841
Goodness-of-fit parameter for all reflections	0.935
Goodness-of-fit parameter for significantly intense reflections	1.037
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
243917 (current)	2019-11-28	cif/ Adding structures of 7702596, 7702597, 7702598 via cif-deposit CGI script.	7702597.cif