Crystallography Open Database

Information card for entry 7203611

7203610 << 7203611 >> 7203612

Preview

Coordinates	7203611.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H30 Cl2 I6 N8
Calculated formula	C40 H30 Cl2 I6 N8
Title of publication	Self-assembly of uniquely structured porphyrin network solids by charged N?H?Cl and N?H?O hydrogen bonds
Authors of publication	Goldberg, Israel; Muniappan, Sankar; George, Sumod; Lipstman, Sophia
Journal of publication	CrystEngComm
Year of publication	2006
Journal volume	8
Journal issue	11
Pages of publication	784
a	14.4525 ± 0.0004 Å
b	20.8624 ± 0.0007 Å
c	7.8359 ± 0.0002 Å
α	90°
β	109.113 ± 0.0017°
γ	90°
Cell volume	2232.39 ± 0.11 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0717
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1285
Weighted residual factors for all reflections included in the refinement	0.1451
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
180367 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/36.	7203611.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7203611.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7203611.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7203611.cif