Crystallography Open Database

Information card for entry 7103624

Preview

Coordinates	7103624.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H41 Ca0.5 N2
Calculated formula	C29 H41 Ca0.5 N2
Title of publication	Lactide polymerization by well-defined calcium coordination complexes: comparisons with related magnesium and zinc chemistry
Authors of publication	Chisholm, Malcolm H.; Gallucci, Judith; Phomphrai, Khamphee
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2003
Journal issue	1
Pages of publication	48 - 49
a	19.513 ± 0.0002 Å
b	12.5265 ± 0.0001 Å
c	22.1472 ± 0.0002 Å
α	90°
β	100.28 ± 0.001°
γ	90°
Cell volume	5326.53 ± 0.08 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	4
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	0.0635
Residual factor for significantly intense reflections	0.0448
Weighted residual factors for all reflections	0.1317
Weighted residual factors for significantly intense reflections	0.1209
Goodness-of-fit parameter for all reflections	1.055
Goodness-of-fit parameter for significantly intense reflections	1.118
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7103624.html