Crystallography Open Database

Information card for entry 4342091

4342090 << 4342091 >> 4342092

Preview

Coordinates	4342091.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H24 N3 O17 Zn4
Calculated formula	C38 H26 N3 O17 Zn4
Title of publication	Predesign and systematic synthesis of 11 highly porous coordination polymers with unprecedented topology.
Authors of publication	Duan, Jingui; Higuchi, Masakazu; Kitagawa, Susumu
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1645 - 1649
a	10.297 ± 0.0006 Å
b	30.9262 ± 0.0017 Å
c	30.5635 ± 0.0016 Å
α	90°
β	91.468 ± 0.001°
γ	90°
Cell volume	9729.7 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1113
Residual factor for significantly intense reflections	0.0799
Weighted residual factors for significantly intense reflections	0.2059
Weighted residual factors for all reflections included in the refinement	0.2253
Goodness-of-fit parameter for all reflections included in the refinement	1.777
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4342091.cif
132813	2015-03-04	cif/ Updating files of 4342086, 4342087, 4342088, 4342089, 4342090, 4342091, 4342092, 4342093, 4342094, 4342095, 4342096 Original log message: Adding full bibliography for 4342086--4342096.cif.	4342091.cif
129797	2015-01-17	cif/ Adding structures of 4342091 via cif-deposit CGI script.	4342091.cif