Crystallography Open Database

Information card for entry 7012588

Preview

Coordinates	7012588.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C99 H80 Cl Mn N18 Ni3 O11
Calculated formula	C99 H80 Cl Mn N18 Ni3 O11
Title of publication	Supramolecular assembly of linear trinickel complexes incorporating metalloporphyrins: a novel one-dimensional polymer and oligomer
Authors of publication	Tsao, Ting-Bin; Lee, Gene-Hsiang; Yeh, Chen-Yu; Peng, Shie-Ming
Journal of publication	Dalton Transactions
Year of publication	2003
Journal issue	8
Pages of publication	1465
a	35.1566 ± 0.0002 Å
b	18.0237 ± 0.0001 Å
c	16.1465 ± 0.0001 Å
α	90°
β	114.929 ± 0.0003°
γ	90°
Cell volume	9278.05 ± 0.1 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0929
Residual factor for significantly intense reflections	0.0611
Weighted residual factors for significantly intense reflections	0.1725
Weighted residual factors for all reflections included in the refinement	0.1975
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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