Crystallography Open Database

Information card for entry 4500196

Preview

Coordinates	4500196.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H44 N8 O10 Zn2
Calculated formula	C58 H44 N8 O10 Zn2
Title of publication	Liquid−Liquid Interphase (Biphasic) as the Reaction Medium in the Assembly of a Hierarchy of Structures of 4,4′-Azodibenzoic Acid with Zinc and Cadmium
Authors of publication	Bhattacharya, Saurav; Sanyal, Udishnu; Natarajan, Srinivasan
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	3
Pages of publication	735
a	29.084 ± 0.005 Å
b	18.553 ± 0.005 Å
c	20.463 ± 0.005 Å
α	90 ± 0.005°
β	107.775 ± 0.005°
γ	90 ± 0.005°
Cell volume	10515 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0794
Residual factor for significantly intense reflections	0.0534
Weighted residual factors for significantly intense reflections	0.1476
Weighted residual factors for all reflections included in the refinement	0.1572
Goodness-of-fit parameter for all reflections included in the refinement	1.087
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
179532 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/01.	4500196.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500196.cif
34400	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500196, 4500197, 4500198, 4500199, 4500200, 4500201 via cif-deposit CGI script.	4500196.cif