Crystallography Open Database

Information card for entry 7216349

Preview

Coordinates	7216349.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H106 N10 O9 Zn2
Calculated formula	C98 H98 N10 O8 Zn2
Title of publication	Control of higher-order structures of zinc chlorophyll coordination polymers
Authors of publication	Shinozaki, Y.; Yoshikawa, I.; Araki, K.; Sugawa, K.; Otsuki, J.
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	39
Pages of publication	9155
a	14.904 ± 0.004 Å
b	14.159 ± 0.003 Å
c	21.949 ± 0.005 Å
α	90°
β	99.879 ± 0.003°
γ	90°
Cell volume	4563.1 ± 1.9 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 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	0.1002
Residual factor for significantly intense reflections	0.0787
Weighted residual factors for significantly intense reflections	0.2032
Weighted residual factors for all reflections included in the refinement	0.2271
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180494 (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 7/21/63.	7216349.cif
124683	2014-10-06	cif/ Updating files of 7216349, 7216350 Original log message: Adding full bibliography for 7216349--7216350.cif.	7216349.cif
115570	2014-06-04	cif/ Adding structures of 7216349, 7216350 via cif-deposit CGI script.	7216349.cif