Crystallography Open Database

Information card for entry 4500846

Preview

Coordinates	4500846.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H21 N3 O9 Zn
Calculated formula	C25 H21 N3 O9 Zn
Title of publication	Coordination Polymers of 5-(2-Amino/Acetamido-4-carboxyphenoxy)-benzene-1,3-dioic Acids with Transition Metal Ions: Synthesis, Structure, and Catalytic Activity
Authors of publication	Karmakar, Anirban; Titi, Hatem M.; Goldberg, Israel
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	6
Pages of publication	2621
a	9.7118 ± 0.0002 Å
b	10.7141 ± 0.0002 Å
c	12.0639 ± 0.0003 Å
α	87.8804 ± 0.0006°
β	84.6264 ± 0.0006°
γ	69.6892 ± 0.0007°
Cell volume	1172.05 ± 0.04 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0423
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0923
Weighted residual factors for all reflections included in the refinement	0.0993
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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