Crystallography Open Database

Information card for entry 7005626

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Coordinates	7005626.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H26 Ca0.19 Er N4 O10
Calculated formula	C48 H26 Ca0.187 Er N4 O10
Title of publication	Framework coordination polymers of tetra(4-carboxyphenyl)porphyrin and lanthanide ions in crystalline solids.
Authors of publication	Lipstman, Sophia; Muniappan, Sankar; George, Sumod; Goldberg, Israel
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2007
Journal issue	30
Pages of publication	3273 - 3281
a	9.4217 ± 0.0008 Å
b	22.1411 ± 0.0019 Å
c	26.34 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	5494.7 ± 1.4 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.0837
Residual factor for significantly intense reflections	0.0424
Weighted residual factors for significantly intense reflections	0.1012
Weighted residual factors for all reflections included in the refinement	0.1095
Goodness-of-fit parameter for all reflections included in the refinement	0.865
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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