Crystallography Open Database

Information card for entry 4332900

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Coordinates	4332900.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H36 N20 Ni2 O Se4
Calculated formula	C45 H35 N20 Ni2 O Se4
Title of publication	Functionalities of One-Dimensional Dynamic Ultramicropores in Nickel(II) Coordination Polymers
Authors of publication	Noro, Shin-ichiro; Kitaura, Ryo; Kitagawa, Susumu; Akutagawa, Tomoyuki; Nakamura, Takayoshi
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	22
Pages of publication	8990 - 8997
a	18.092 ± 0.003 Å
b	31.514 ± 0.005 Å
c	19.15 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	10918 ± 3 Å³
Cell temperature	93.1 K
Number of distinct elements	6
Space group number	68
Hermann-Mauguin space group symbol	C c c a :2
Hall space group symbol	-C 2a 2ac
Residual factor for significantly intense reflections	0.0557
Weighted residual factors for all reflections included in the refinement	0.0645
Goodness-of-fit parameter for all reflections included in the refinement	1.245
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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