Crystallography Open Database

Information card for entry 1503263

Preview

Coordinates	1503263.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C157.5 H200 Ge N20 O6.5 Si3
Calculated formula	C157.5 H190 Ge N20 O6.5 Si3
Title of publication	Modular face-to-face assembly of multichromophore arrays that absorb across the complete UV-visible spectrum and into the near-IR.
Authors of publication	Zhao, Zhixin; Cammidge, Andrew N.; Hughes, David L.; Cook, Michael J.
Journal of publication	Organic letters
Year of publication	2010
Journal volume	12
Journal issue	22
Pages of publication	5138 - 5141
a	16.2858 ± 0.0003 Å
b	17.5573 ± 0.0003 Å
c	26.2012 ± 0.0005 Å
α	87.426 ± 0.001°
β	74.596 ± 0.001°
γ	83.114 ± 0.001°
Cell volume	7169.9 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.096
Residual factor for significantly intense reflections	0.0763
Weighted residual factors for significantly intense reflections	0.1678
Weighted residual factors for all reflections included in the refinement	0.1773
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1503263.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1503263.cif
37140	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 1503263 via cif-deposit CGI script.	1503263.cif