Crystallography Open Database

Information card for entry 4114808

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Coordinates	4114808.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C120 H94 N8 O7 Zn4
Calculated formula	C120 H94 N8 O7 Zn4
Title of publication	Flexible Inner and Outer Coordination of Zn(II) N-Confused Porphyrin Complex
Authors of publication	Hiroyuki Furuta; Tomoya Ishizuka; Atsuhiro Osuka
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	5622 - 5623
a	26.327 ± 0.001 Å
b	17.0084 ± 0.0008 Å
c	26.99 ± 0.001 Å
α	90°
β	121.266 ± 0.002°
γ	90°
Cell volume	10330.4 ± 0.8 Å³
Cell temperature	296.1 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 significantly intense reflections	0.07
Weighted residual factors for all reflections included in the refinement	0.098
Goodness-of-fit parameter for all reflections included in the refinement	0.228
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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