Crystallography Open Database

Information card for entry 7216819

Preview

Coordinates	7216819.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H70 Cd5 N24 O22
Calculated formula	C84 H58 Cd5 N24 O22
Title of publication	Four cluster-containing highly connected coordination networks: syntheses, structures, and properties
Authors of publication	Du, Peng; Yang, Yan; Kang, Da-Wei; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	28
Pages of publication	6372
a	11.014 ± 0.005 Å
b	13.17 ± 0.005 Å
c	14.773 ± 0.0008 Å
α	88.002 ± 0.004°
β	83.199 ± 0.004°
γ	86.478 ± 0.003°
Cell volume	2123 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.042
Residual factor for significantly intense reflections	0.0324
Weighted residual factors for significantly intense reflections	0.0743
Weighted residual factors for all reflections included in the refinement	0.0801
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180499 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/68.	7216819.cif
118214	2014-06-27	cif/ Adding structures of 7216816, 7216817, 7216818, 7216819 via cif-deposit CGI script.	7216819.cif