Crystallography Open Database

Information card for entry 7701301

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Coordinates	7701301.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C118 H96 B2 Br Ce N4 P4
Calculated formula	C118 H96 B2 Br Ce N4 P4
Title of publication	Cerium-carbon dative interactions supported by carbodiphosphorane.
Authors of publication	Su, Wei; Pan, Sudip; Sun, Xiong; Zhao, Lili; Frenking, Gernot; Zhu, Congqing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	42
Pages of publication	16108 - 16114
a	17.0971 ± 0.0011 Å
b	30.3657 ± 0.0018 Å
c	19.5806 ± 0.0013 Å
α	90°
β	104.649 ± 0.003°
γ	90°
Cell volume	9835.1 ± 1.1 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0542
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.1156
Weighted residual factors for all reflections included in the refinement	0.1198
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	1.34139 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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