Crystallography Open Database

Information card for entry 7023552

Preview

Coordinates	7023552.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92.62 H60.62 Cl1.85 N4 O4 Zn
Calculated formula	C92.616 H60.616 Cl1.848 N4 O4 Zn
Title of publication	Control of the spatial arrangements of supramolecular networks based on saddle-distorted porphyrins by intermolecular hydrogen bonding.
Authors of publication	Ishizuka, Tomoya; Sankar, Muniappan; Kojima, Takahiko
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	45
Pages of publication	16073 - 16079
a	28.0259 ± 0.0019 Å
b	28.0259 ± 0.0019 Å
c	10.1867 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	8001.2 ± 0.9 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1253
Residual factor for significantly intense reflections	0.0931
Weighted residual factors for significantly intense reflections	0.2985
Weighted residual factors for all reflections included in the refinement	0.3126
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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