Crystallography Open Database

Information card for entry 7214616

Preview

Coordinates	7214616.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C200 H188 N4 O42 Zn8
Calculated formula	C200 H188 N4 O42 Zn8
Title of publication	Chiral porous metal‒organic frameworks from chiral building units with different metrics
Authors of publication	Li, Qiaowei; Shin, Sung Min; Moon, Dohyun; Jeong, Kyung Seok; Jeong, Nakcheol
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	47
Pages of publication	10161
a	22.945 ± 0.005 Å
b	31.803 ± 0.006 Å
c	32.955 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	24048 ± 9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1115
Residual factor for significantly intense reflections	0.0788
Weighted residual factors for significantly intense reflections	0.1906
Weighted residual factors for all reflections included in the refinement	0.2107
Goodness-of-fit parameter for all reflections included in the refinement	0.993
Diffraction radiation wavelength	0.9 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180477 (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 7/21/46.	7214616.cif
110322	2014-04-18	cif/ Adding structures of 7214615, 7214616 via cif-deposit CGI script.	7214616.cif