Crystallography Open Database

Information card for entry 4000114

Preview

Coordinates	4000114.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H33.5 Cl2 Cu N4 O2.75
Calculated formula	C26 H28 Cl2 Cu N4 O2.75
Journal of publication	Chemistry of Materials
Year of publication	2002
a	17.221 ± 0.0007 Å
b	17.221 ± 0.0007 Å
c	40.9649 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	12148.7 ± 0.9 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.121
Residual factor for significantly intense reflections	0.0991
Weighted residual factors for all reflections	0.2678
Weighted residual factors for significantly intense reflections	0.2555
Goodness-of-fit parameter for all reflections	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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