Crystallography Open Database

Information card for entry 7701491

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Coordinates	7701491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 Ca N4 O9
Calculated formula	C21 H19 Ca N3 O8
Title of publication	The impact of metal cations on photochemical properties of hybrid heterostructures with infinite alkaline-earth metal oxide clusters
Authors of publication	You, Ming-Hua; Li, Meng-Hua; Li, Hao-Hong; Chen, Yong; Lin, Mei-Jin
Journal of publication	Dalton Transactions
Year of publication	2019
a	28.1585 ± 0.0017 Å
b	28.1585 ± 0.0017 Å
c	13.456 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	10669.3 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.1356
Residual factor for significantly intense reflections	0.0702
Weighted residual factors for significantly intense reflections	0.154
Weighted residual factors for all reflections included in the refinement	0.1773
Goodness-of-fit parameter for all reflections included in the refinement	0.992
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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