Crystallography Open Database

Information card for entry 7243391

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Coordinates	7243391.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H53 N5 O10 Zn
Calculated formula	C48 H53 N5 O10 Zn
Title of publication	Steric crowding of a series of pyridine based ligands influencing the photophysical properties of Zn(II) complexes
Authors of publication	Ejarque, Daniel; Calvet, Teresa; Font-Bardia, Mercè; Pons, Josefina
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	35
Pages of publication	6199 - 6213
a	11.8153 ± 0.0009 Å
b	12.2801 ± 0.0011 Å
c	17.4928 ± 0.0016 Å
α	108.449 ± 0.004°
β	96.437 ± 0.004°
γ	102.812 ± 0.004°
Cell volume	2301.7 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1056
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.1551
Weighted residual factors for all reflections included in the refinement	0.1849
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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