Crystallography Open Database

Information card for entry 2240961

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Structure parameters

Common name	Zn CbzMOF - MeOH
Chemical name	Poly[[[μ~4~-5-(9<i>H</i>-carbazol-9-yl)isophthalato][μ~3~-5-(9<i>H</i>-carbazol-9-yl)isophthalato]bis(dimethylformamide)(methanol)dizinc] dimethylformamide monosolvate]
Formula	C50 H47 N5 O12 Zn2
Calculated formula	C50 H47 N5 O12 Zn2
Title of publication	Crystal structure of poly[[[μ~4~-5-(9<i>H</i>-carbazol-9-yl)isophthalato][μ~3~-5-(9<i>H</i>-carbazol-9-yl)isophthalato]bis(dimethylformamide)(methanol)dizinc] dimethylformamide monosolvate]
Authors of publication	Lifshits, Liubov M.; Campana, Charles; Klosterman, Jeremy K.
Journal of publication	Acta Crystallographica Section E
Year of publication	2015
Journal volume	71
Journal issue	8
Pages of publication	m152 - m153
a	10.2867 ± 0.0004 Å
b	17.0328 ± 0.0007 Å
c	26.8808 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	4709.8 ± 0.3 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	0.0189
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.0451
Weighted residual factors for all reflections included in the refinement	0.0452
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181909 (current)	2016-04-06	hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/09	2240961.cif 2240961.hkl
153018	2015-08-07	cif/ hkl/ Adding structures of 2240961 via cif-deposit CGI script.	2240961.cif 2240961.hkl