Crystallography Open Database

Information card for entry 1548659

Preview

Coordinates	1548659.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H78 B2 Fe2 N8 O2 P2 Zn2
Calculated formula	C78 H78 B2 Fe2 N8 O2 P2 Zn2
Title of publication	Preparation of multiblock copolymers <i>via</i> step-wise addition of l-lactide and trimethylene carbonate.
Authors of publication	Abubekerov, Mark; Wei, Junnian; Swartz, Kevin R.; Xie, Zhixin; Pei, Qibing; Diaconescu, Paula L.
Journal of publication	Chemical science
Year of publication	2018
Journal volume	9
Journal issue	8
Pages of publication	2168 - 2178
a	13.855 ± 0.004 Å
b	9.378 ± 0.002 Å
c	30.742 ± 0.008 Å
α	90°
β	101.648 ± 0.003°
γ	90°
Cell volume	3912.1 ± 1.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0979
Residual factor for significantly intense reflections	0.0793
Weighted residual factors for significantly intense reflections	0.2114
Weighted residual factors for all reflections included in the refinement	0.2198
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
228680 (current)	2019-11-17	cif/ Updating files of 1548659 Original log message: Adding full bibliography for 1548659.cif.	1548659.cif
205101	2018-01-12	cif/ Adding structures of 1548659 via cif-deposit CGI script.	1548659.cif