Crystallography Open Database

Information card for entry 7230573

Preview

Coordinates	7230573.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H33 Cd N5 O9
Calculated formula	C27 H33 Cd N5 O9
Title of publication	Bulky substituent and solvent-induced alternative nodes for layered Cd‒isophthalate/acylhydrazone frameworks
Authors of publication	Roztocki, Kornel; Lupa, Magdalena; Hodorowicz, Maciej; Senkovska, Irena; Kaskel, Stefan; Matoga, Dariusz
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	20
Pages of publication	2841
a	10.215 ± 0.0002 Å
b	11.9013 ± 0.0002 Å
c	12.6419 ± 0.0002 Å
α	80.608 ± 0.001°
β	84.697 ± 0.001°
γ	80.66 ± 0.001°
Cell volume	1492.76 ± 0.05 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.027
Residual factor for significantly intense reflections	0.0264
Weighted residual factors for significantly intense reflections	0.0695
Weighted residual factors for all reflections included in the refinement	0.0699
Goodness-of-fit parameter for all reflections included in the refinement	1.075
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
229043 (current)	2019-11-17	cif/ Updating files of 7230572, 7230573, 7230574 Original log message: Adding full bibliography for 7230572--7230574.cif.	7230573.cif
207594	2018-05-01	cif/ Adding structures of 7230572, 7230573, 7230574 via cif-deposit CGI script.	7230573.cif