Crystallography Open Database

Information card for entry 1508063

Preview

Coordinates	1508063.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H16 N10 O Zn
Calculated formula	C41 H16 N10 O Zn
Title of publication	Selective sorption of oxygen and nitric oxide by an electron-donating flexible porous coordination polymer.
Authors of publication	Shimomura, Satoru; Higuchi, Masakazu; Matsuda, Ryotaro; Yoneda, Ko; Hijikata, Yuh; Kubota, Yoshiki; Mita, Yoshimi; Kim, Jungeun; Takata, Masaki; Kitagawa, Susumu
Journal of publication	Nature chemistry
Year of publication	2010
Journal volume	2
Journal issue	8
Pages of publication	633 - 637
a	11.419 ± 0.004 Å
b	12.67 ± 0.005 Å
c	14.752 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	2134.3 ± 1.3 Å³
Cell temperature	223.1 K
Ambient diffraction temperature	223.1 K
Number of distinct elements	5
Space group number	49
Hermann-Mauguin space group symbol	P c c m
Hall space group symbol	-P 2 2c
Residual factor for significantly intense reflections	0.0816
Weighted residual factors for all reflections included in the refinement	0.0955
Goodness-of-fit parameter for all reflections included in the refinement	0.917
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1508063.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1508063.cif
62609	2012-07-09	cif/ Adding structures of 1508063 via cif-deposit CGI script.	1508063.cif